Basic information
- CAS
1346575-98-1- Standard SMILES
Cc1cc(C(C)C)c(CN)c(=O)[nH]1- InChIKey
JSRPCAOFGDZBRH-UHFFFAOYSA-N- Molecular formula
- C10H16N2O
- Average molar mass
- 180.25 g/mol
- Monoisotopic mass
- 180.12626313
Names & identifiers
- Preferred name
- 3-(aminomethyl)-4-isopropyl-6-methylpyridin-2(1H)-one
- IUPAC
- 3-(aminomethyl)-6-methyl-4-propan-2-yl-1H-pyridin-2-one
Names & synonyms
3-(aminomethyl)-4-isopropyl-6-methylpyridin-2(1H)-one1346575-98-13-(aminomethyl)-6-methyl-4-propan-2-yl-1H-pyridin-2-oneSCHEMBL1695084SCHEMBL13281846DTXSID10736484JSRPCAOFGDZBRH-UHFFFAOYSA-N3-(aminomethyl)-6-methyl-4-(1-methylethyl)-2(1h)-pyridinoneAT14160CS-01121243-(AMINOMETHYL)-4-ISOPROPYL-6-METHYL-1H-PYRIDIN-2-ONE3-(aminomethyl)-6-methyl-4-(1-methylethyl)2(1H)-pyridinone
Show more names
3-(Aminomethyl)-6-methyl-4-(propan-2-yl)pyridin-2(1H)-one3-(aminomethyl)-6-methyl-4-(propan-2-yl)-1,2-dihydropyridin-2-one
Database identifiers
- CAS
1346575-98-1- PubChem CID
- 67124337
- DTXSID
DTXSID10736484
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 287
Related reactions
18 records
Compound notes
Loading…