N-(1-benzylpiperidin-3-yl)butanamide

C16H24N2O — CID 60756097

IUPACN-(1-benzylpiperidin-3-yl)butanamide
SMILESCCCC(=O)NC1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C16H24N2O/c1-2-7-16(19)17-15-10-6-11-18(13-15)12-14-8-4-3-5-9-14/h3-5,8-9,15H,2,6-7,10-13H2,1H3,(H,17,19)
InChIKeyWUKIIPQROGCFCE-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.57
Rot. Bonds5

About N-(1-benzylpiperidin-3-yl)butanamide

N-(1-benzylpiperidin-3-yl)butanamide (PubChem CID 60756097) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(1-benzylpiperidin-3-yl)butanamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-3-yl)butanamide
PubChem CID60756097
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(1-benzylpiperidin-3-yl)butanamide
SMILESCCCC(=O)NC1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C16H24N2O/c1-2-7-16(19)17-15-10-6-11-18(13-15)12-14-8-4-3-5-9-14/h3-5,8-9,15H,2,6-7,10-13H2,1H3,(H,17,19)
InChIKeyWUKIIPQROGCFCE-UHFFFAOYSA-N
XLogP2.57
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-benzylpiperidin-3-yl)-3-phenylpropanamide
CID 42958724
N-[(3S)-1-benzylpiperidin-3-yl]acetamide
CID 58526543
N-(1-benzylpiperidin-3-yl)-2-(propan-2-ylamino)acetamide
CID 64590485
1-(1-benzylpiperidin-3-yl)-3-cyclobutylurea
CID 115617829
(2S)-2-amino-N-(1-benzylpiperidin-3-yl)butanamide
CID 79022762
3-amino-N-(1-benzylpiperidin-3-yl)butanamide;dihydrochloride
CID 119856024
N-(1-benzylpyrrolidin-3-yl)-3-(ethylamino)propanamide
CID 62833579
2-(azepan-1-yl)-N-[(3S)-1-benzylpyrrolidin-3-yl]acetamide
CID 131913098
1-benzyl-3-[(3S)-1-benzylpiperidin-3-yl]urea
CID 51941035
N-[(3R)-1-benzylpyrrolidin-3-yl]-4-phenylbutanamide
CID 51947538
N-(1-benzylpiperidin-3-yl)-2-methylbenzamide
CID 42958722
N-(1-benzylpiperidin-3-yl)-2-pyrrolidin-2-ylacetamide
CID 119856028

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-3-yl)butanamide?
The IUPAC name of N-(1-benzylpiperidin-3-yl)butanamide (CID 60756097) is N-(1-benzylpiperidin-3-yl)butanamide.
What is the SMILES notation for N-(1-benzylpiperidin-3-yl)butanamide?
The canonical SMILES for N-(1-benzylpiperidin-3-yl)butanamide is CCCC(=O)NC1CCCN(Cc2ccccc2)C1.
What is the InChIKey of N-(1-benzylpiperidin-3-yl)butanamide?
The InChIKey is WUKIIPQROGCFCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-7-16(19)17-15-10-6-11-18(13-15)12-14-8-4-3-5-9-14/h3-5,8-9,15H,2,6-7,10-13H2,1H3,(H,17,19).
What are the key properties of N-(1-benzylpiperidin-3-yl)butanamide?
N-(1-benzylpiperidin-3-yl)butanamide has a molecular weight of 260.38 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-3-yl)butanamide is sourced from PubChem (CID 60756097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).