6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one

C17H21N3O2 — CID 51567844

IUPAC6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one
SMILESCc1cc(NC[C@@H]2CCCO2)cc(=O)n1Cc1cccnc1
InChIInChI=1S/C17H21N3O2/c1-13-8-15(19-11-16-5-3-7-22-16)9-17(21)20(13)12-14-4-2-6-18-10-14/h2,4,6,8-10,16,19H,3,5,7,11-12H2,1H3/t16-/m0/s1
InChIKeyDCRGCEBFBAMTMO-INIZCTEOSA-N
MW299.37 g/mol
LogP2.19
Rot. Bonds5

About 6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one

6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one (PubChem CID 51567844) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is 6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one.

Molecular Properties

Compound Name6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one
PubChem CID51567844
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC Name6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one
SMILESCc1cc(NC[C@@H]2CCCO2)cc(=O)n1Cc1cccnc1
InChIInChI=1S/C17H21N3O2/c1-13-8-15(19-11-16-5-3-7-22-16)9-17(21)20(13)12-14-4-2-6-18-10-14/h2,4,6,8-10,16,19H,3,5,7,11-12H2,1H3/t16-/m0/s1
InChIKeyDCRGCEBFBAMTMO-INIZCTEOSA-N
XLogP2.19
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one with MolForge

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Related Compounds

4-(benzylamino)-6-methyl-1-[[(2S)-oxolan-2-yl]methyl]pyridin-2-one
CID 51568108
N-(oxolan-2-ylmethyl)-4-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
CID 109206754
N-(oxolan-2-ylmethyl)-7-(pyridin-3-ylmethyl)-5,6,8,9-tetrahydropyrimido[4,5-d]azepin-4-amine
CID 56900440
6-(oxolan-2-ylmethyl)-1-(pyridin-3-ylmethyl)pyrrolo[2,3-c]pyridin-7-one
CID 53164579
1-[[(2R)-oxolan-2-yl]methyl]-3-(pyridin-3-ylmethyl)thiourea
CID 51428347
3-methyl-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 62254757
3-N-methyl-5-N-(oxolan-2-ylmethyl)pyridine-3,5-diamine
CID 104532738
N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide
CID 110865617
2-chloro-N-(oxolan-2-ylmethyl)-5-[4-(pyridin-3-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide
CID 55513446
(1S)-N-(oxolan-2-ylmethyl)-1-pyridin-3-ylethanamine
CID 81404067
2-(3-methylphenyl)-N-[4-(oxolan-2-ylmethylamino)phenyl]acetamide
CID 112981217
N-(3-methyl-4-pyridinyl)-2-[[(2S)-oxolan-2-yl]methylamino]acetamide
CID 124698301

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one?
The IUPAC name of 6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one (CID 51567844) is 6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one.
What is the SMILES notation for 6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one?
The canonical SMILES for 6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one is Cc1cc(NC[C@@H]2CCCO2)cc(=O)n1Cc1cccnc1.
What is the InChIKey of 6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one?
The InChIKey is DCRGCEBFBAMTMO-INIZCTEOSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-13-8-15(19-11-16-5-3-7-22-16)9-17(21)20(13)12-14-4-2-6-18-10-14/h2,4,6,8-10,16,19H,3,5,7,11-12H2,1H3/t16-/m0/s1.
What are the key properties of 6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one?
6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one has a molecular weight of 299.37 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-[[(2S)-oxolan-2-yl]methylamino]-1-(pyridin-3-ylmethyl)pyridin-2-one is sourced from PubChem (CID 51567844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).