N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide

C13H18ClN3O2 — CID 137450142

IUPACN-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(Cl)cn(C2CCN(C)CC2)c1=O
InChIInChI=1S/C13H18ClN3O2/c1-9(18)15-12-7-10(14)8-17(13(12)19)11-3-5-16(2)6-4-11/h7-8,11H,3-6H2,1-2H3,(H,15,18)
InChIKeyYGIHDSUBQOMKOT-UHFFFAOYSA-N
MW283.76 g/mol
LogP1.73
Rot. Bonds2

About N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide

N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide (PubChem CID 137450142) has the molecular formula C13H18ClN3O2 and a molecular weight of 283.76 g/mol. Its IUPAC name is N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide
PubChem CID137450142
Molecular FormulaC13H18ClN3O2
Molecular Weight283.76 g/mol
Exact Mass283.11
IUPAC NameN-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(Cl)cn(C2CCN(C)CC2)c1=O
InChIInChI=1S/C13H18ClN3O2/c1-9(18)15-12-7-10(14)8-17(13(12)19)11-3-5-16(2)6-4-11/h7-8,11H,3-6H2,1-2H3,(H,15,18)
InChIKeyYGIHDSUBQOMKOT-UHFFFAOYSA-N
XLogP1.73
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-acetamido-2-oxo-1-pyridinyl)-N-cyclohexylacetamide
CID 45268244
N-[1-(2-amino-2-oxoethyl)piperidin-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 72046541
N-(1-ethyl-6-oxo-3-pyridinyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 71849994
6-[(3-piperidin-1-ylazetidin-1-yl)carbonyl]pyridin-2(1H)-one
CID 91786659
6-[(3S)-4-cyclopentyl-3-methylpiperazine-1-carbonyl]-1H-pyridin-2-one
CID 164640688
5-Fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one
CID 137449036
1-[(3S)-1-(2-fluoroethyl)piperidin-3-yl]-3-(methylamino)pyridin-2-one
CID 137449077
1-[(3R)-1-(2-fluoroethyl)piperidin-3-yl]-3-(methylamino)pyridin-2-one
CID 137449078
1-[1-(2,2-Difluoroethyl)piperidin-4-yl]-3-(propan-2-ylamino)pyridin-2-one
CID 137449097
1-[1-(2-Fluoroethyl)piperidin-4-yl]-3-(methylamino)pyridin-2-one
CID 137449100
1-[1-(2-Fluoroethyl)piperidin-3-yl]-3-(methylamino)pyridin-2-one
CID 137449107
1-[(4S)-3,3-difluoro-1-methylpiperidin-4-yl]-3-(methylamino)pyridin-2-one
CID 137449496

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide?
The IUPAC name of N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide (CID 137450142) is N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide.
What is the SMILES notation for N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide?
The canonical SMILES for N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide is CC(=O)Nc1cc(Cl)cn(C2CCN(C)CC2)c1=O.
What is the InChIKey of N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide?
The InChIKey is YGIHDSUBQOMKOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN3O2/c1-9(18)15-12-7-10(14)8-17(13(12)19)11-3-5-16(2)6-4-11/h7-8,11H,3-6H2,1-2H3,(H,15,18).
What are the key properties of N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide?
N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide has a molecular weight of 283.76 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-chloro-1-(1-methylpiperidin-4-yl)-2-oxo-3-pyridinyl]acetamide is sourced from PubChem (CID 137450142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).