1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide

C20H29N3O2 — CID 42881192

IUPAC1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide
SMILESCC(=O)N1CCC(N2CCC(C(=O)Nc3ccc(C)cc3)CC2)CC1
InChIInChI=1S/C20H29N3O2/c1-15-3-5-18(6-4-15)21-20(25)17-7-11-23(12-8-17)19-9-13-22(14-10-19)16(2)24/h3-6,17,19H,7-14H2,1-2H3,(H,21,25)
InChIKeyXXUHLVXIWFDHIS-UHFFFAOYSA-N
MW343.47 g/mol
LogP2.66
Rot. Bonds3

About 1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide

1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide (PubChem CID 42881192) has the molecular formula C20H29N3O2 and a molecular weight of 343.47 g/mol. Its IUPAC name is 1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide
PubChem CID42881192
Molecular FormulaC20H29N3O2
Molecular Weight343.47 g/mol
Exact Mass343.23
IUPAC Name1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide
SMILESCC(=O)N1CCC(N2CCC(C(=O)Nc3ccc(C)cc3)CC2)CC1
InChIInChI=1S/C20H29N3O2/c1-15-3-5-18(6-4-15)21-20(25)17-7-11-23(12-8-17)19-9-13-22(14-10-19)16(2)24/h3-6,17,19H,7-14H2,1-2H3,(H,21,25)
InChIKeyXXUHLVXIWFDHIS-UHFFFAOYSA-N
XLogP2.66
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-acetylpiperidin-4-yl)-N-(4-methoxyphenyl)piperidine-4-carboxamide
CID 42693365
1-[1-(2,2-diphenylacetyl)piperidin-4-yl]-N-(4-methylphenyl)piperidine-4-carboxamide
CID 46171987
N-(4-methylphenyl)-1-[1-[3-(trifluoromethyl)benzoyl]piperidin-4-yl]piperidine-4-carboxamide
CID 42693352
N-(4-acetylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide
CID 113007858
1-acetyl-N-(4-nitrophenyl)piperidine-4-carboxamide
CID 108792167
1-acetyl-N-[4-(4-chlorophenoxy)phenyl]piperidine-4-carboxamide
CID 6468150
N-(4-methoxyphenyl)-1-(1-propanoylpiperidin-4-yl)piperidine-4-carboxamide
CID 42881212
1-acetyl-N-[4-(2-methylpropyl)phenyl]piperidine-4-carboxamide
CID 110792561
1-acetyl-N-[4-(1,3-dioxolan-2-yl)phenyl]piperidine-4-carboxamide
CID 110745350
4-cyclopropyl-N-(4-methylphenyl)piperazine-1-carboxamide
CID 47455397
1-(1-benzoylpiperidin-4-yl)-N-(4-fluorophenyl)piperidine-4-carboxamide
CID 42693290
1-acetyl-N-(3-bromo-5-methylphenyl)piperidine-4-carboxamide
CID 110671730

Frequently Asked Questions

What is the IUPAC name of 1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide (CID 42881192) is 1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide is CC(=O)N1CCC(N2CCC(C(=O)Nc3ccc(C)cc3)CC2)CC1.
What is the InChIKey of 1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide?
The InChIKey is XXUHLVXIWFDHIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O2/c1-15-3-5-18(6-4-15)21-20(25)17-7-11-23(12-8-17)19-9-13-22(14-10-19)16(2)24/h3-6,17,19H,7-14H2,1-2H3,(H,21,25).
What are the key properties of 1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide?
1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide has a molecular weight of 343.47 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-acetylpiperidin-4-yl)-N-(4-methylphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 42881192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).