3-piperidin-4-yl-N-pyridin-4-ylbutanamide

C14H21N3O — CID 119827125

IUPAC3-piperidin-4-yl-N-pyridin-4-ylbutanamide
SMILESCC(CC(=O)Nc1ccncc1)C1CCNCC1
InChIInChI=1S/C14H21N3O/c1-11(12-2-6-15-7-3-12)10-14(18)17-13-4-8-16-9-5-13/h4-5,8-9,11-12,15H,2-3,6-7,10H2,1H3,(H,16,17,18)
InChIKeyPZWVQMXEIOOUQW-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.05
Rot. Bonds4

About 3-piperidin-4-yl-N-pyridin-4-ylbutanamide

3-piperidin-4-yl-N-pyridin-4-ylbutanamide (PubChem CID 119827125) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 3-piperidin-4-yl-N-pyridin-4-ylbutanamide.

Molecular Properties

Compound Name3-piperidin-4-yl-N-pyridin-4-ylbutanamide
PubChem CID119827125
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name3-piperidin-4-yl-N-pyridin-4-ylbutanamide
SMILESCC(CC(=O)Nc1ccncc1)C1CCNCC1
InChIInChI=1S/C14H21N3O/c1-11(12-2-6-15-7-3-12)10-14(18)17-13-4-8-16-9-5-13/h4-5,8-9,11-12,15H,2-3,6-7,10H2,1H3,(H,16,17,18)
InChIKeyPZWVQMXEIOOUQW-UHFFFAOYSA-N
XLogP2.05
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(carbamoylamino)phenyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119701454
3-piperidin-4-yl-N-(4-propan-2-ylphenyl)butanamide;hydrochloride
CID 119672812
N-(3-acetamidophenyl)-3-piperidin-4-ylbutanamide
CID 119671646
3-piperidin-4-yl-N-[1-(pyridin-4-ylmethyl)pyrazol-4-yl]butanamide
CID 119871215
N-[3-(phenylcarbamoylamino)phenyl]-3-piperidin-4-ylbutanamide
CID 119700701
3-piperidin-4-yl-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide;hydrochloride
CID 119399813
N-[4-[[2-(dimethylamino)acetyl]amino]phenyl]-3-piperidin-4-ylbutanamide;dihydrochloride
CID 119885324
methyl 4-(3-piperidin-4-ylbutanoylamino)benzoate
CID 119671385
3-piperidin-4-yl-N-[4-(triazol-1-yl)phenyl]butanamide
CID 119762393
N-(3-chlorophenyl)-3-piperidin-4-ylbutanamide
CID 119671037
3-piperidin-4-yl-N-thiophen-3-ylbutanamide;hydrochloride
CID 119788959
N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-3-piperidin-4-ylbutanamide
CID 119848540

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yl-N-pyridin-4-ylbutanamide?
The IUPAC name of 3-piperidin-4-yl-N-pyridin-4-ylbutanamide (CID 119827125) is 3-piperidin-4-yl-N-pyridin-4-ylbutanamide.
What is the SMILES notation for 3-piperidin-4-yl-N-pyridin-4-ylbutanamide?
The canonical SMILES for 3-piperidin-4-yl-N-pyridin-4-ylbutanamide is CC(CC(=O)Nc1ccncc1)C1CCNCC1.
What is the InChIKey of 3-piperidin-4-yl-N-pyridin-4-ylbutanamide?
The InChIKey is PZWVQMXEIOOUQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-11(12-2-6-15-7-3-12)10-14(18)17-13-4-8-16-9-5-13/h4-5,8-9,11-12,15H,2-3,6-7,10H2,1H3,(H,16,17,18).
What are the key properties of 3-piperidin-4-yl-N-pyridin-4-ylbutanamide?
3-piperidin-4-yl-N-pyridin-4-ylbutanamide has a molecular weight of 247.34 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yl-N-pyridin-4-ylbutanamide is sourced from PubChem (CID 119827125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).