3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide

C25H26N2O2 — CID 33215004

IUPAC3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide
SMILESO=C(CCN1CCC(C(=O)c2ccccc2)CC1)Nc1cccc2ccccc12
InChIInChI=1S/C25H26N2O2/c28-24(26-23-12-6-10-19-7-4-5-11-22(19)23)15-18-27-16-13-21(14-17-27)25(29)20-8-2-1-3-9-20/h1-12,21H,13-18H2,(H,26,28)
InChIKeyCDCQJLXPVJDJGZ-UHFFFAOYSA-N
MW386.50 g/mol
LogP4.76
Rot. Bonds6

About 3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide

3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide (PubChem CID 33215004) has the molecular formula C25H26N2O2 and a molecular weight of 386.50 g/mol. Its IUPAC name is 3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide.

Molecular Properties

Compound Name3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide
PubChem CID33215004
Molecular FormulaC25H26N2O2
Molecular Weight386.50 g/mol
Exact Mass386.20
IUPAC Name3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide
SMILESO=C(CCN1CCC(C(=O)c2ccccc2)CC1)Nc1cccc2ccccc12
InChIInChI=1S/C25H26N2O2/c28-24(26-23-12-6-10-19-7-4-5-11-22(19)23)15-18-27-16-13-21(14-17-27)25(29)20-8-2-1-3-9-20/h1-12,21H,13-18H2,(H,26,28)
InChIKeyCDCQJLXPVJDJGZ-UHFFFAOYSA-N
XLogP4.76
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-[3-(naphthalen-1-ylamino)-3-oxopropyl]piperidin-4-yl]propanoic acid
CID 146107417
3-(4-benzoylpiperidin-1-yl)-N-(3-chlorophenyl)propanamide
CID 33215010
N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide
CID 33215029
3-(4-benzoylpiperidin-1-yl)-N-(4-sulfamoylphenyl)propanamide
CID 33215032
N-naphthalen-1-yl-3-(3-piperidin-1-ylazetidin-1-yl)propanamide
CID 91830165
[1-(2-aminoethyl)piperidin-4-yl]-phenylmethanone
CID 91529814
propan-2-yl 3-(4-benzoylpiperidin-1-yl)propanoate
CID 56807214
N-naphthalen-1-yl-3-[4-(piperazine-1-carbonyl)piperazin-1-yl]propanamide
CID 154866210
2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide
CID 26037570
N,N'-dinaphthalen-1-ylbutanediamide
CID 1346643
3-(2-methylmorpholin-4-yl)-N-naphthalen-1-ylpropanamide
CID 46683190
3-[4-(furan-2-ylmethyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide
CID 30737698

Frequently Asked Questions

What is the IUPAC name of 3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide?
The IUPAC name of 3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide (CID 33215004) is 3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide.
What is the SMILES notation for 3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide?
The canonical SMILES for 3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide is O=C(CCN1CCC(C(=O)c2ccccc2)CC1)Nc1cccc2ccccc12.
What is the InChIKey of 3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide?
The InChIKey is CDCQJLXPVJDJGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O2/c28-24(26-23-12-6-10-19-7-4-5-11-22(19)23)15-18-27-16-13-21(14-17-27)25(29)20-8-2-1-3-9-20/h1-12,21H,13-18H2,(H,26,28).
What are the key properties of 3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide?
3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide has a molecular weight of 386.50 g/mol, XLogP of 4.76, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide is sourced from PubChem (CID 33215004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).