1,1-Dimethyl-3-(pyridin-3-ylmethyl)urea

Substructure search Find similar structures

Basic information

CAS: 41915-99-5
Standard SMILES: CN(C)C(=O)NCc1cccnc1
InChIKey: YNRVAYREOPJJOB-UHFFFAOYSA-N
Molecular formula: C9H13N3O
Average molar mass: 179.22 g/mol
Monoisotopic mass: 179.10586205

Names & identifiers

Preferred name: 1,1-Dimethyl-3-(pyridin-3-ylmethyl)urea
IUPAC: 1,1-dimethyl-3-(pyridin-3-ylmethyl)urea

Names & synonyms

1,1-dimethyl-3-(pyridin-3-ylmethyl)urea41915-99-5DTXSID90307898RefChem:213764DTXCID90259025N,N-Dimethyl-N'-[(pyridin-3-yl)methyl]ureaNSC196206Oprea1_132723HMS1652G13AKOS001656109NSC-196206ST50754143

Show more names

(dimethylamino)-N-(3-pyridylmethyl)carboxamideSR-01000471260SR-01000471260-1Z166703568

Database identifiers

CAS: 41915-99-5
PubChem CID: 304385
DTXSID: DTXSID90307898

Properties

Computed structural properties

XLogP: 0
Topological polar surface area: 45.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 13
Formal charge: 0
Complexity: 170

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…