3-아미노-6-(4-메틸피페라진-1-일)피리딘

6-(4-Methylpiperazin-1-yl)pyridin-3-amine

HCID 2763390CAS 55403-35-5

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CN1CCN(c2ccc(N)cn2)CC1
InChIKey: NZTCEWZBMOTKCJ-UHFFFAOYSA-N
분자식: C10H16N4
평균 분자량: 192.26 g/mol
단동위원소 질량: 192.13749651

이름 및 식별자

우선 이름: 6-(4-Methylpiperazin-1-yl)pyridin-3-amine
IUPAC: 6-(4-methylpiperazin-1-yl)pyridin-3-amine
현지명: 3-아미노-6-(4-메틸피페라진-1-일)피리딘
영어명: 3-Amino-6-(4-methylpiperazin-1-yl)pyridine
분자식: C10H16N4
분자량: 192.26

이름 및 동의어

55403-35-56-(4-methylpiperazin-1-yl)pyridin-3-amineDTXSID80376932RefChem:104044DTXCID40327960819-101-33-Amino-6-(4-methylpiperazin-1-yl)pyridine6-(4-methylpiperazino)-3-pyridinamine6-(4-methyl-piperazin-1-yl)-pyridin-3-ylamineMFCD034257196-(4-methyl-1-piperazinyl)-3-pyridinamine1-(5-Aminopyridin-2-yl)-4-methylpiperazine

이름 더 보기

3-아미노-6-(4-메틸피페라진-1-일)피리딘6-(4-Methyl-1-piperazinyl)-3-pyridinaMine 4HCl3-Amino-6-(4-methylpiperazin-1-yl)pyridine Hydrochloride6-(4-methyl-1-piperazinyl)-3-pyridinamine(SALTDATA: FREE)6-(4-methylpiperazin-1-yl)pyridin-3-amine tetrahydrochloride

3-Amino-6-(4-methyl-1-piperazinyl)pyridine6-(4-Methyl-piperazin-1-yl)pyridin-3-ylamine3-PYRIDINAMINE, 6-(4-METHYL-1-PIPERAZINYL)-6-(4-methylpiperazinyl)-3-pyridylamine5-Amino-2-(4-methylpiperazin-1-yl)pyridineFT-0680023A8NWQ3KXY9SCHEMBL55623

데이터베이스 식별자

CAS: 55403-35-5
PubChem CID: 2763390
DTXSID: DTXSID80376932
UNII: A8NWQ3KXY9
EC Number: 819-101-3
Nikkaji: J3.018.774A

물성

구조 계산 물성

XLogP: 0.4
극성 표면적: 45.4 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 4
회전 가능 결합 수: 1
무거운 원자 수: 14
형식 전하: 0
복잡도: 177

물리화학적 성질

녹는점: 106 · 106-108°
끓는 점: 388.7 · 388.7±42.0 °C(Predicted)
밀도: 1.142 · 1.142±0.06 g/cm3(Predicted)
저장 조건: -20 °C · Keep in dark place,Sealed in dry,Store in freezer, under -20°C
산도 계수 (pKa): 9.35 · 9.35±0.29(Predicted)
InChI: InChI=1S/C10H16N4/c1-13-4-6-14(7-5-13)10-3-2-9(11)8-12-10/h2-3,8H,4-7,11H2,1H3
InChIKey: NZTCEWZBMOTKCJ-UHFFFAOYSA-N
SMILES: C1=NC(N2CCN(C)CC2)=CC=C1N

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.