4-(3-propylpiperidine-1-carbonyl)benzamide

C16H22N2O2 — CID 119163399

IUPAC4-(3-propylpiperidine-1-carbonyl)benzamide
SMILESCCCC1CCCN(C(=O)c2ccc(C(N)=O)cc2)C1
InChIInChI=1S/C16H22N2O2/c1-2-4-12-5-3-10-18(11-12)16(20)14-8-6-13(7-9-14)15(17)19/h6-9,12H,2-5,10-11H2,1H3,(H2,17,19)
InChIKeyRDEOBKQYUURQSI-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.44
Rot. Bonds4

About 4-(3-propylpiperidine-1-carbonyl)benzamide

4-(3-propylpiperidine-1-carbonyl)benzamide (PubChem CID 119163399) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 4-(3-propylpiperidine-1-carbonyl)benzamide.

Molecular Properties

Compound Name4-(3-propylpiperidine-1-carbonyl)benzamide
PubChem CID119163399
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name4-(3-propylpiperidine-1-carbonyl)benzamide
SMILESCCCC1CCCN(C(=O)c2ccc(C(N)=O)cc2)C1
InChIInChI=1S/C16H22N2O2/c1-2-4-12-5-3-10-18(11-12)16(20)14-8-6-13(7-9-14)15(17)19/h6-9,12H,2-5,10-11H2,1H3,(H2,17,19)
InChIKeyRDEOBKQYUURQSI-UHFFFAOYSA-N
XLogP2.44
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-fluorophenyl)-(3-propylpiperidin-1-yl)methanone
CID 23552315
4-(3-propylpyrrolidine-1-carbonyl)benzoic acid
CID 112700698
3-propylpiperidine-1-carboxamide
CID 18466872
4-[3-(2-hydroxyethyl)piperidine-1-carbonyl]benzenecarbothioamide
CID 107227391
[3-(2-aminoethyl)piperidin-1-yl]-(4-bromophenyl)methanone;hydrochloride
CID 120727628
4-[(3S)-3-hydroxypiperidine-1-carbonyl]benzamide
CID 93040598
[3-(2-aminoethyl)piperidin-1-yl]-(4-fluorophenyl)methanone
CID 63766318
(3-ethylpiperidin-1-yl)-(4-fluorophenyl)methanone
CID 23552313
3-[(3S)-1-(4-acetylbenzoyl)piperidin-3-yl]propanoic acid
CID 124681890
[3-(bromomethyl)piperidin-1-yl]-(4-bromophenyl)methanone
CID 80661392
[3-(2-aminoethyl)piperidin-1-yl]-(3,4-dimethylphenyl)methanone
CID 63767469
[3-(2-aminoethyl)piperidin-1-yl]-[4-(trifluoromethyl)phenyl]methanone
CID 63765933

Frequently Asked Questions

What is the IUPAC name of 4-(3-propylpiperidine-1-carbonyl)benzamide?
The IUPAC name of 4-(3-propylpiperidine-1-carbonyl)benzamide (CID 119163399) is 4-(3-propylpiperidine-1-carbonyl)benzamide.
What is the SMILES notation for 4-(3-propylpiperidine-1-carbonyl)benzamide?
The canonical SMILES for 4-(3-propylpiperidine-1-carbonyl)benzamide is CCCC1CCCN(C(=O)c2ccc(C(N)=O)cc2)C1.
What is the InChIKey of 4-(3-propylpiperidine-1-carbonyl)benzamide?
The InChIKey is RDEOBKQYUURQSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-2-4-12-5-3-10-18(11-12)16(20)14-8-6-13(7-9-14)15(17)19/h6-9,12H,2-5,10-11H2,1H3,(H2,17,19).
What are the key properties of 4-(3-propylpiperidine-1-carbonyl)benzamide?
4-(3-propylpiperidine-1-carbonyl)benzamide has a molecular weight of 274.36 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-propylpiperidine-1-carbonyl)benzamide is sourced from PubChem (CID 119163399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).