4-(benzylamino)piperidine-1-carboxamide

C13H19N3O — CID 43757030

IUPAC4-(benzylamino)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(NCc2ccccc2)CC1
InChIInChI=1S/C13H19N3O/c14-13(17)16-8-6-12(7-9-16)15-10-11-4-2-1-3-5-11/h1-5,12,15H,6-10H2,(H2,14,17)
InChIKeyMLIARRQGLKCYOY-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.32
Rot. Bonds3

About 4-(benzylamino)piperidine-1-carboxamide

4-(benzylamino)piperidine-1-carboxamide (PubChem CID 43757030) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 4-(benzylamino)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(benzylamino)piperidine-1-carboxamide
PubChem CID43757030
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name4-(benzylamino)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(NCc2ccccc2)CC1
InChIInChI=1S/C13H19N3O/c14-13(17)16-8-6-12(7-9-16)15-10-11-4-2-1-3-5-11/h1-5,12,15H,6-10H2,(H2,14,17)
InChIKeyMLIARRQGLKCYOY-UHFFFAOYSA-N
XLogP1.32
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[2-(benzylamino)-2-oxoethyl]amino]piperidine-1-carboxamide
CID 60972447
4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide
CID 43769393
benzyl 4-(benzylamino)piperidine-1-carboxylate
CID 44828828
4-[(3-nitrophenyl)methylamino]piperidine-1-carboxamide
CID 62505759
4-[[4-(difluoromethylsulfanyl)phenyl]methylamino]piperidine-1-carboxamide
CID 75476343
4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)piperidine-1-carboxamide
CID 43766812
N-benzyl-1-methylpiperidin-4-amine
CID 1114650
cyclopropyl-[4-[(4-phenylphenyl)methylamino]piperidin-1-yl]methanone;hydrochloride
CID 56808716
2-[4-(benzylamino)piperidin-1-yl]-N-methylacetamide
CID 38056640
N-benzyl-1-methylsulfinylpiperidin-4-amine
CID 145040513
3-(benzylamino)-5-propylpiperidine-1-carboxamide
CID 83993642
4-[2-(2-methylphenyl)ethylamino]piperidine-1-carboxamide
CID 79762949

Frequently Asked Questions

What is the IUPAC name of 4-(benzylamino)piperidine-1-carboxamide?
The IUPAC name of 4-(benzylamino)piperidine-1-carboxamide (CID 43757030) is 4-(benzylamino)piperidine-1-carboxamide.
What is the SMILES notation for 4-(benzylamino)piperidine-1-carboxamide?
The canonical SMILES for 4-(benzylamino)piperidine-1-carboxamide is NC(=O)N1CCC(NCc2ccccc2)CC1.
What is the InChIKey of 4-(benzylamino)piperidine-1-carboxamide?
The InChIKey is MLIARRQGLKCYOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c14-13(17)16-8-6-12(7-9-16)15-10-11-4-2-1-3-5-11/h1-5,12,15H,6-10H2,(H2,14,17).
What are the key properties of 4-(benzylamino)piperidine-1-carboxamide?
4-(benzylamino)piperidine-1-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzylamino)piperidine-1-carboxamide is sourced from PubChem (CID 43757030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).