3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one

C16H17N3O2 — CID 129353314

IUPAC3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one
SMILESO=C(c1ccc(-c2ccncc2)[nH]c1=O)N1CCCCC1
InChIInChI=1S/C16H17N3O2/c20-15-13(16(21)19-10-2-1-3-11-19)4-5-14(18-15)12-6-8-17-9-7-12/h4-9H,1-3,10-11H2,(H,18,20)
InChIKeyISCVLDJNVPGHKJ-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.06
Rot. Bonds2

About 3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one

3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one (PubChem CID 129353314) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one
PubChem CID129353314
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one
SMILESO=C(c1ccc(-c2ccncc2)[nH]c1=O)N1CCCCC1
InChIInChI=1S/C16H17N3O2/c20-15-13(16(21)19-10-2-1-3-11-19)4-5-14(18-15)12-6-8-17-9-7-12/h4-9H,1-3,10-11H2,(H,18,20)
InChIKeyISCVLDJNVPGHKJ-UHFFFAOYSA-N
XLogP2.06
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-oxo-6-pyridin-4-yl-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxylic acid
CID 119356855
ethane;2-oxo-6-pyridin-4-yl-1H-pyridine-3-carboxylic acid
CID 91141021
(2-fluoro-4-pyridin-4-ylphenyl)-pyrrolidin-1-ylmethanone
CID 143120198
3-[(2R,3R)-2-(aminomethyl)-3-methylpiperidine-1-carbonyl]-6-pyridin-4-yl-1H-pyridin-2-one
CID 124592587
3-[3-(methylamino)piperidine-1-carbonyl]-6-phenyl-1H-pyridin-2-one
CID 119491224
6-phenyl-3-(1,3-thiazolidine-3-carbonyl)-1H-pyridin-2-one
CID 125483735
1-[4-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperazin-1-yl]-2-pyrrolidin-1-ylethane-1,2-dione
CID 55867890
2-phenyl-5-(piperidine-1-carbonyl)-1H-pyrimidin-6-one
CID 92648674
N-(cyanomethyl)-2-oxo-6-pyridin-4-yl-1H-pyridine-3-carboxamide
CID 125478368
3-(2-oxa-9-azaspiro[4.5]decane-9-carbonyl)-6-phenyl-1H-pyridin-2-one
CID 72876722
3-[3-(1-aminoethyl)piperidine-1-carbonyl]-6-phenyl-1H-pyridin-2-one
CID 119595143
3-[4-(2,5-difluorobenzoyl)piperidine-1-carbonyl]-6-phenyl-1H-pyridin-2-one
CID 75404213

Frequently Asked Questions

What is the IUPAC name of 3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one?
The IUPAC name of 3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one (CID 129353314) is 3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one.
What is the SMILES notation for 3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one?
The canonical SMILES for 3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one is O=C(c1ccc(-c2ccncc2)[nH]c1=O)N1CCCCC1.
What is the InChIKey of 3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one?
The InChIKey is ISCVLDJNVPGHKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c20-15-13(16(21)19-10-2-1-3-11-19)4-5-14(18-15)12-6-8-17-9-7-12/h4-9H,1-3,10-11H2,(H,18,20).
What are the key properties of 3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one?
3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one has a molecular weight of 283.33 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(piperidine-1-carbonyl)-6-pyridin-4-yl-1H-pyridin-2-one is sourced from PubChem (CID 129353314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).