5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one

C17H18N4O2 — CID 121379046

IUPAC5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one
SMILESCc1noc(C)c1-c1c[nH]c(=O)c(N[C@H](C)c2ccccn2)c1
InChIInChI=1S/C17H18N4O2/c1-10(14-6-4-5-7-18-14)20-15-8-13(9-19-17(15)22)16-11(2)21-23-12(16)3/h4-10,20H,1-3H3,(H,19,22)/t10-/m1/s1
InChIKeyDHIGTVXAMTWVKR-SNVBAGLBSA-N
MW310.36 g/mol
LogP3.21
Rot. Bonds4

About 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one

5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one (PubChem CID 121379046) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one
PubChem CID121379046
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC Name5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one
SMILESCc1noc(C)c1-c1c[nH]c(=O)c(N[C@H](C)c2ccccn2)c1
InChIInChI=1S/C17H18N4O2/c1-10(14-6-4-5-7-18-14)20-15-8-13(9-19-17(15)22)16-11(2)21-23-12(16)3/h4-10,20H,1-3H3,(H,19,22)/t10-/m1/s1
InChIKeyDHIGTVXAMTWVKR-SNVBAGLBSA-N
XLogP3.21
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one with MolForge

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Related Compounds

5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-(1-methylpyridin-1-ium-2-yl)ethyl]amino]-1H-pyridin-2-one
CID 177247086
5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-(pyridin-2-ylmethoxy)-1H-pyridin-2-one
CID 121379032
5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-(pyridin-4-ylmethylamino)-1H-pyridin-2-one
CID 121379049
4-[[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1H-pyridin-3-yl]amino]benzonitrile
CID 121379040
7-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methoxy-2-oxo-4-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-quinoline-3-carboxamide
CID 167441304
4-[3-iodo-1-[(1S)-1-pyridin-2-ylethyl]indazol-6-yl]-3,5-dimethyl-1,2-oxazole
CID 118937079
5-iodo-4-(1-pyridin-2-ylethylamino)-1H-pyrimidin-6-one
CID 136973979
7-amino-6-(1-pyridin-2-ylethylamino)-4H-1,4-benzoxazin-3-one
CID 43524329
2,5-dimethyl-N-(1-pyridin-2-ylethyl)aniline
CID 43196549
3,5-dimethyl-4-[1-[(1S)-1-pyridin-2-ylethyl]pyrrolo[2,3-b]pyridin-5-yl]-1,2-oxazole
CID 155195055
5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[5-[(1-propan-2-yltriazol-4-yl)methoxy]-2-pyridinyl]methylamino]-1H-pyridin-2-one
CID 171638287
3,5-dimethyl-N-(1-pyridin-2-ylethyl)aniline
CID 43195401

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one?
The IUPAC name of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one (CID 121379046) is 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one.
What is the SMILES notation for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one?
The canonical SMILES for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one is Cc1noc(C)c1-c1c[nH]c(=O)c(N[C@H](C)c2ccccn2)c1.
What is the InChIKey of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one?
The InChIKey is DHIGTVXAMTWVKR-SNVBAGLBSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-10(14-6-4-5-7-18-14)20-15-8-13(9-19-17(15)22)16-11(2)21-23-12(16)3/h4-10,20H,1-3H3,(H,19,22)/t10-/m1/s1.
What are the key properties of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one?
5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one has a molecular weight of 310.36 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[[(1R)-1-pyridin-2-ylethyl]amino]-1H-pyridin-2-one is sourced from PubChem (CID 121379046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).