1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide

C18H26N2O2 — CID 6469814

IUPAC1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide
SMILESCCC(NC(=O)C1CCN(C(C)=O)CC1)c1ccc(C)cc1
InChIInChI=1S/C18H26N2O2/c1-4-17(15-7-5-13(2)6-8-15)19-18(22)16-9-11-20(12-10-16)14(3)21/h5-8,16-17H,4,9-12H2,1-3H3,(H,19,22)
InChIKeyDVZKZQCCKWBDSA-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.82
Rot. Bonds4

About 1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide

1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide (PubChem CID 6469814) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is 1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide
PubChem CID6469814
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC Name1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide
SMILESCCC(NC(=O)C1CCN(C(C)=O)CC1)c1ccc(C)cc1
InChIInChI=1S/C18H26N2O2/c1-4-17(15-7-5-13(2)6-8-15)19-18(22)16-9-11-20(12-10-16)14(3)21/h5-8,16-17H,4,9-12H2,1-3H3,(H,19,22)
InChIKeyDVZKZQCCKWBDSA-UHFFFAOYSA-N
XLogP2.82
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,2-dimethylpropanoyl)-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide
CID 134028904
tert-butyl 4-[[(1S)-1-(4-methylphenyl)propyl]carbamoyl]piperidine-1-carboxylate
CID 9155664
N-[1-(4-methylphenyl)propyl]cyclopentanecarboxamide
CID 6469111
1-[(4-methylphenyl)methyl]-N-[(1R)-1-(4-methylphenyl)propyl]piperidine-4-carboxamide
CID 94024761
N-[(1R)-1-(4-methylphenyl)propyl]cyclohexanecarboxamide
CID 92675793
1-[(3-methylphenyl)methyl]-N-[(1R)-1-(4-methylphenyl)propyl]piperidine-4-carboxamide
CID 94024759
1-(cyclopentanecarbonyl)-N-[(1R)-1-(4-hydroxyphenyl)propyl]piperidine-4-carboxamide
CID 97189714
1-[(2-chlorophenyl)methylsulfonyl]-N-[(1S)-1-(4-methylphenyl)propyl]piperidine-4-carboxamide
CID 94012854
1-ethylsulfonyl-N-[1-(4-methylphenyl)propyl]piperidine-3-carboxamide
CID 50946502
(3R)-1-ethylsulfonyl-N-[(1R)-1-(4-methylphenyl)propyl]piperidine-3-carboxamide
CID 95118826
1-methyl-N-(1-phenylpropyl)piperidine-4-carboxamide
CID 50875269
N-[1-(4-methylphenyl)propyl]-1-(1-methylpyrrol-3-yl)sulfonylpiperidine-4-carboxamide
CID 42940269

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide?
The IUPAC name of 1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide (CID 6469814) is 1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide?
The canonical SMILES for 1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide is CCC(NC(=O)C1CCN(C(C)=O)CC1)c1ccc(C)cc1.
What is the InChIKey of 1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide?
The InChIKey is DVZKZQCCKWBDSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-4-17(15-7-5-13(2)6-8-15)19-18(22)16-9-11-20(12-10-16)14(3)21/h5-8,16-17H,4,9-12H2,1-3H3,(H,19,22).
What are the key properties of 1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide?
1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide has a molecular weight of 302.42 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-[1-(4-methylphenyl)propyl]piperidine-4-carboxamide is sourced from PubChem (CID 6469814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).