3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide

C15H23N3O — CID 81043996

IUPAC3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide
SMILESCC(CC(=O)NCc1ccccn1)C1CCCNC1
InChIInChI=1S/C15H23N3O/c1-12(13-5-4-7-16-10-13)9-15(19)18-11-14-6-2-3-8-17-14/h2-3,6,8,12-13,16H,4-5,7,9-11H2,1H3,(H,18,19)
InChIKeyFVBDMFOCCRHXGO-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.72
Rot. Bonds5

About 3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide

3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide (PubChem CID 81043996) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide.

Molecular Properties

Compound Name3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide
PubChem CID81043996
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide
SMILESCC(CC(=O)NCc1ccccn1)C1CCCNC1
InChIInChI=1S/C15H23N3O/c1-12(13-5-4-7-16-10-13)9-15(19)18-11-14-6-2-3-8-17-14/h2-3,6,8,12-13,16H,4-5,7,9-11H2,1H3,(H,18,19)
InChIKeyFVBDMFOCCRHXGO-UHFFFAOYSA-N
XLogP1.72
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-piperidin-3-ylbutanoylamino)-N-(pyridin-2-ylmethyl)benzamide
CID 119848954
N-[(3-ethyl-2-pyridinyl)methyl]-3-piperidin-3-ylbutanamide
CID 82737570
N-[(3-methyl-2-pyridinyl)methyl]-3-piperidin-3-ylbutanamide;dihydrochloride
CID 119869388
N-[(2-methoxy-3-pyridinyl)methyl]-3-piperidin-3-ylbutanamide
CID 81049427
3-piperidin-3-yl-N-pyrimidin-2-ylbutanamide
CID 81043820
N-[[1-(2-phenylethyl)imidazol-2-yl]methyl]-3-piperidin-3-ylbutanamide
CID 119898673
N-[(2-methoxyphenyl)methyl]-3-piperidin-3-ylbutanamide
CID 81048441
N-[(5-phenyl-1,3,4-thiadiazol-2-yl)methyl]-3-piperidin-3-ylbutanamide;hydrochloride
CID 119816636
N-(azepan-4-yl)-3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide
CID 122081130
3-piperidin-3-yl-N-[[2-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]butanamide;dihydrochloride
CID 119847133
N-(2-methyl-3-pyridinyl)-3-piperidin-3-ylbutanamide
CID 81043884
N-[(2-nitrophenyl)methyl]-3-piperidin-3-ylbutanamide
CID 119706778

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide?
The IUPAC name of 3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide (CID 81043996) is 3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide.
What is the SMILES notation for 3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide?
The canonical SMILES for 3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide is CC(CC(=O)NCc1ccccn1)C1CCCNC1.
What is the InChIKey of 3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide?
The InChIKey is FVBDMFOCCRHXGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-12(13-5-4-7-16-10-13)9-15(19)18-11-14-6-2-3-8-17-14/h2-3,6,8,12-13,16H,4-5,7,9-11H2,1H3,(H,18,19).
What are the key properties of 3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide?
3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide has a molecular weight of 261.37 g/mol, XLogP of 1.72, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide is sourced from PubChem (CID 81043996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).