N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide

C13H18N4O2 — CID 119871359

IUPACN-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide
SMILESO=C(CNC(=O)C1CCCNC1)Nc1cccnc1
InChIInChI=1S/C13H18N4O2/c18-12(17-11-4-2-6-15-8-11)9-16-13(19)10-3-1-5-14-7-10/h2,4,6,8,10,14H,1,3,5,7,9H2,(H,16,19)(H,17,18)
InChIKeyQMADXTCDGOVKKW-UHFFFAOYSA-N
MW262.31 g/mol
LogP0.14
Rot. Bonds4

About N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide

N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide (PubChem CID 119871359) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide
PubChem CID119871359
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC NameN-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide
SMILESO=C(CNC(=O)C1CCCNC1)Nc1cccnc1
InChIInChI=1S/C13H18N4O2/c18-12(17-11-4-2-6-15-8-11)9-16-13(19)10-3-1-5-14-7-10/h2,4,6,8,10,14H,1,3,5,7,9H2,(H,16,19)(H,17,18)
InChIKeyQMADXTCDGOVKKW-UHFFFAOYSA-N
XLogP0.14
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3-fluoroanilino)-2-oxoethyl]piperidine-3-carboxamide;hydrochloride
CID 119308754
N-(2-anilino-2-oxoethyl)pyrrolidine-3-carboxamide
CID 119738367
N-(2-pyridin-3-ylethyl)piperidine-3-carboxamide;dihydrochloride
CID 119842424
N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide
CID 114956004
N-[3-oxo-3-(pyridin-3-ylamino)propyl]pyrrolidine-2-carboxamide
CID 119873237
(3R)-N-[(1R)-1-pyridin-3-ylethyl]piperidine-3-carboxamide
CID 81404831
N-[3-oxo-3-(pyridin-3-ylamino)propyl]pyrrolidine-2-carboxamide;dihydrochloride
CID 119873236
(2S,5R)-5-(aminomethyl)-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]oxolane-2-carboxamide;dihydrochloride
CID 120799515
N-(pyridin-4-ylmethyl)piperidine-3-carboxamide;hydrochloride
CID 56832251
N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide
CID 156839204
(3R)-N-(pyridazin-3-ylmethyl)piperidine-3-carboxamide
CID 106896121
(3S)-N-[(6-methyl-3-pyridinyl)methyl]piperidine-3-carboxamide
CID 81140194

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide?
The IUPAC name of N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide (CID 119871359) is N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide?
The canonical SMILES for N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide is O=C(CNC(=O)C1CCCNC1)Nc1cccnc1.
What is the InChIKey of N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide?
The InChIKey is QMADXTCDGOVKKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c18-12(17-11-4-2-6-15-8-11)9-16-13(19)10-3-1-5-14-7-10/h2,4,6,8,10,14H,1,3,5,7,9H2,(H,16,19)(H,17,18).
What are the key properties of N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide?
N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 0.14, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-(pyridin-3-ylamino)ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 119871359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).