3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide

C15H21N5O — CID 119856901

IUPAC3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide
SMILESCC(CC(=O)Nc1nnc2ccccn12)C1CCCNC1
InChIInChI=1S/C15H21N5O/c1-11(12-5-4-7-16-10-12)9-14(21)17-15-19-18-13-6-2-3-8-20(13)15/h2-3,6,8,11-12,16H,4-5,7,9-10H2,1H3,(H,17,19,21)
InChIKeyCETVNIZHOYGUMV-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.69
Rot. Bonds4

About 3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide

3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide (PubChem CID 119856901) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide.

Molecular Properties

Compound Name3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide
PubChem CID119856901
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide
SMILESCC(CC(=O)Nc1nnc2ccccn12)C1CCCNC1
InChIInChI=1S/C15H21N5O/c1-11(12-5-4-7-16-10-12)9-14(21)17-15-19-18-13-6-2-3-8-20(13)15/h2-3,6,8,11-12,16H,4-5,7,9-10H2,1H3,(H,17,19,21)
InChIKeyCETVNIZHOYGUMV-UHFFFAOYSA-N
XLogP1.69
TPSA71.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-ethylbenzimidazol-2-yl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119678519
3-piperidin-3-yl-N-pyrimidin-2-ylbutanamide
CID 81043820
3-piperidin-3-yl-N-(2-propan-2-yloxyphenyl)butanamide
CID 119714859
1-[2-(3-piperidin-3-ylbutanoylamino)phenyl]pyrazole-3-carboxamide;hydrochloride
CID 119762042
N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-3-piperidin-3-ylbutanamide
CID 119691926
N-(2-chlorophenyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119670792
N-(3-chloro-2-pyridinyl)-3-piperidin-3-ylbutanamide
CID 103094136
N-[2,6-di(propan-2-yl)phenyl]-3-piperidin-3-ylbutanamide
CID 119671508
3-piperidin-3-yl-N-pyrimidin-5-ylbutanamide
CID 107588596
3-(3-piperidin-3-ylbutanoylamino)benzamide
CID 81049250
N-(2-methyl-3-pyridinyl)-3-piperidin-3-ylbutanamide
CID 81043884
N-[2-(methanesulfonamido)phenyl]-3-piperidin-3-ylbutanamide
CID 119704023

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide?
The IUPAC name of 3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide (CID 119856901) is 3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide.
What is the SMILES notation for 3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide?
The canonical SMILES for 3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide is CC(CC(=O)Nc1nnc2ccccn12)C1CCCNC1.
What is the InChIKey of 3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide?
The InChIKey is CETVNIZHOYGUMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-11(12-5-4-7-16-10-12)9-14(21)17-15-19-18-13-6-2-3-8-20(13)15/h2-3,6,8,11-12,16H,4-5,7,9-10H2,1H3,(H,17,19,21).
What are the key properties of 3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide?
3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide has a molecular weight of 287.37 g/mol, XLogP of 1.69, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-3-yl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanamide is sourced from PubChem (CID 119856901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).