4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide

C12H18N4O — CID 43769393

IUPAC4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(NCc2ccncc2)CC1
InChIInChI=1S/C12H18N4O/c13-12(17)16-7-3-11(4-8-16)15-9-10-1-5-14-6-2-10/h1-2,5-6,11,15H,3-4,7-9H2,(H2,13,17)
InChIKeyWOVZHAWNJMHKQA-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.71
Rot. Bonds3

About 4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide

4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide (PubChem CID 43769393) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide
PubChem CID43769393
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(NCc2ccncc2)CC1
InChIInChI=1S/C12H18N4O/c13-12(17)16-7-3-11(4-8-16)15-9-10-1-5-14-6-2-10/h1-2,5-6,11,15H,3-4,7-9H2,(H2,13,17)
InChIKeyWOVZHAWNJMHKQA-UHFFFAOYSA-N
XLogP0.71
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(benzylamino)piperidine-1-carboxamide
CID 43757030
4-[[4-(difluoromethylsulfanyl)phenyl]methylamino]piperidine-1-carboxamide
CID 75476343
4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide
CID 61283472
4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)piperidine-1-carboxamide
CID 43766812
1-tert-butyl-N-(pyridin-4-ylmethyl)piperidin-4-amine
CID 51085983
4-[[2-(benzylamino)-2-oxoethyl]amino]piperidine-1-carboxamide
CID 60972447
N-(pyridin-4-ylmethyl)cyclooctanamine
CID 4722994
N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine
CID 43675588
ethyl 4-[[3-oxo-3-(pyridin-4-ylmethylamino)propyl]amino]piperidine-1-carboxylate
CID 109023796
4-[(3-nitrophenyl)methylamino]piperidine-1-carboxamide
CID 62505759
[4-(pyridin-4-ylmethylamino)cyclohexyl]methanol
CID 103753143
4-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]piperidine-1-carboxamide
CID 71975057

Frequently Asked Questions

What is the IUPAC name of 4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide?
The IUPAC name of 4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide (CID 43769393) is 4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide.
What is the SMILES notation for 4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide?
The canonical SMILES for 4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide is NC(=O)N1CCC(NCc2ccncc2)CC1.
What is the InChIKey of 4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide?
The InChIKey is WOVZHAWNJMHKQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c13-12(17)16-7-3-11(4-8-16)15-9-10-1-5-14-6-2-10/h1-2,5-6,11,15H,3-4,7-9H2,(H2,13,17).
What are the key properties of 4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide?
4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 0.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide is sourced from PubChem (CID 43769393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).