2-(4-piperidin-4-ylbutyl)benzamide

C16H24N2O — CID 143660610

IUPAC2-(4-piperidin-4-ylbutyl)benzamide
SMILESNC(=O)c1ccccc1CCCCC1CCNCC1
InChIInChI=1S/C16H24N2O/c17-16(19)15-8-4-3-7-14(15)6-2-1-5-13-9-11-18-12-10-13/h3-4,7-8,13,18H,1-2,5-6,9-12H2,(H2,17,19)
InChIKeyLCJDPZZCJZWQND-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.50
Rot. Bonds6

About 2-(4-piperidin-4-ylbutyl)benzamide

2-(4-piperidin-4-ylbutyl)benzamide (PubChem CID 143660610) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-(4-piperidin-4-ylbutyl)benzamide.

Molecular Properties

Compound Name2-(4-piperidin-4-ylbutyl)benzamide
PubChem CID143660610
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-(4-piperidin-4-ylbutyl)benzamide
SMILESNC(=O)c1ccccc1CCCCC1CCNCC1
InChIInChI=1S/C16H24N2O/c17-16(19)15-8-4-3-7-14(15)6-2-1-5-13-9-11-18-12-10-13/h3-4,7-8,13,18H,1-2,5-6,9-12H2,(H2,17,19)
InChIKeyLCJDPZZCJZWQND-UHFFFAOYSA-N
XLogP2.50
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[2-(4-cyclohexylbutyl)phenyl]ethanone
CID 102374896
4-[3-(2-methylphenyl)propyl]piperidine
CID 54301052
2-octylbenzamide
CID 11148995
2-butylbenzamide
CID 15468173
2-(3-chloropropyl)benzamide
CID 135741565
2-[2-(4-cyclohexylbutyl)benzoyl]oxyacetic acid
CID 141194857
2-[[(3S)-piperidin-3-yl]methyl]benzamide
CID 154457528
benzene-1,2-dicarboxamide;piperazine
CID 159137360
4-[3-(2-methoxyphenyl)propyl]piperidine
CID 22751111
5-[2-(4-cyclopropylbutyl)phenyl]-2,2-dimethylpentanoic acid
CID 175871242
2-[7-(hydroxyamino)-7-oxoheptyl]benzamide
CID 87127603
6-[2-(5-cyclopropylpentyl)phenyl]-2,2-dimethylhexanoic acid
CID 166652827

Frequently Asked Questions

What is the IUPAC name of 2-(4-piperidin-4-ylbutyl)benzamide?
The IUPAC name of 2-(4-piperidin-4-ylbutyl)benzamide (CID 143660610) is 2-(4-piperidin-4-ylbutyl)benzamide.
What is the SMILES notation for 2-(4-piperidin-4-ylbutyl)benzamide?
The canonical SMILES for 2-(4-piperidin-4-ylbutyl)benzamide is NC(=O)c1ccccc1CCCCC1CCNCC1.
What is the InChIKey of 2-(4-piperidin-4-ylbutyl)benzamide?
The InChIKey is LCJDPZZCJZWQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c17-16(19)15-8-4-3-7-14(15)6-2-1-5-13-9-11-18-12-10-13/h3-4,7-8,13,18H,1-2,5-6,9-12H2,(H2,17,19).
What are the key properties of 2-(4-piperidin-4-ylbutyl)benzamide?
2-(4-piperidin-4-ylbutyl)benzamide has a molecular weight of 260.38 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-piperidin-4-ylbutyl)benzamide is sourced from PubChem (CID 143660610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).