Basic information
- CAS
2055-12-1- Standard SMILES
Cc1ncccc1C1CCCCN1- InChIKey
NXOCBSTXRGDTGJ-UHFFFAOYSA-N- Molecular formula
- C11H16N2
- Average molar mass
- 176.26 g/mol
- Monoisotopic mass
- 176.13134851
Overview
RN given refers to (+-)-isomer; structure
Names & identifiers
- Preferred name
- Methylanabasine
- IUPAC
- 2-methyl-3-piperidin-2-ylpyridine
- English name
- METHYLANABASINE
- Molecular formula
- C11H16N2
- Molecular weight
- 176.26
Names & synonyms
RefChem:9257662055-12-1Methylanabasine2-Methylanabasine2-Methyl-3-(2-piperidinyl)pyridine2-methyl-3-piperidin-2-ylpyridine2-METHYL-3-(PIPERIDIN-2-YL)PYRIDINE64114-20-1Pyridine, 2-methyl-3-(2-piperidinyl)-SCHEMBL1721243DTXSID90942728NXOCBSTXRGDTGJ-UHFFFAOYSA-N
Show more names
Pyridine, 3-(1-methyl-2-piperidinyl)-
AKOS00637405769567-20-0EN300-2001183Pyridine, 3-(1-methyl-2-piperidinyl)-, (+-)-
Database identifiers
- CAS
2055-12-1、69567-20-0- PubChem CID
- 3053192
- DTXSID
DTXSID90942728
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 158
Physicochemical properties
- Boiling point
- 268 °C · 268 °C
- Density
- 1.007 · 1.007±0.06 g/cm3(Predicted)
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Oil
- pka
- 8.76 · 8.76±0.10(Predicted)
- color
- Yellow
Chemistry & industry
Suppliers7 total
成都乐美天医药科技有限公司17308096051 17308096051 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
海济医药科技（苏州）有限公司18012778619 · [email protected]
中山市科信生物技术有限公司0760-+86-0760-88665202 13824707890
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
2 records
Compound notes
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