1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide

C20H28N2O3 — CID 110793800

IUPAC1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)NCc2ccc(OC3CCCC3)cc2)CC1
InChIInChI=1S/C20H28N2O3/c1-15(23)22-12-10-17(11-13-22)20(24)21-14-16-6-8-19(9-7-16)25-18-4-2-3-5-18/h6-9,17-18H,2-5,10-14H2,1H3,(H,21,24)
InChIKeyPOIVEJWFAWEJFC-UHFFFAOYSA-N
MW344.45 g/mol
LogP2.88
Rot. Bonds5

About 1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide

1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide (PubChem CID 110793800) has the molecular formula C20H28N2O3 and a molecular weight of 344.45 g/mol. Its IUPAC name is 1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide
PubChem CID110793800
Molecular FormulaC20H28N2O3
Molecular Weight344.45 g/mol
Exact Mass344.21
IUPAC Name1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)NCc2ccc(OC3CCCC3)cc2)CC1
InChIInChI=1S/C20H28N2O3/c1-15(23)22-12-10-17(11-13-22)20(24)21-14-16-6-8-19(9-7-16)25-18-4-2-3-5-18/h6-9,17-18H,2-5,10-14H2,1H3,(H,21,24)
InChIKeyPOIVEJWFAWEJFC-UHFFFAOYSA-N
XLogP2.88
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.45
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-cyclohexyloxyphenyl)methyl]piperidine-4-carboxamide
CID 119312792
1-acetyl-N-[(4-ethylsulfanylphenyl)methyl]piperidine-4-carboxamide
CID 110794531
N-[(4-cyclohexyloxyphenyl)methyl]piperidine-3-carboxamide
CID 119312808
1-(2-cyclopentylcyclopropanecarbonyl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 154842260
N-[(4-cyclohexyloxyphenyl)methyl]-3-(hydroxymethyl)pyrrolidine-1-carboxamide
CID 111443943
N-[(4-methoxyphenyl)methyl]-4-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109145605
2-amino-N-[(4-cyclopentyloxyphenyl)methyl]acetamide
CID 96676286
1-(cyclopent-3-ene-1-carbonyl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 131894163
N-[(4-cyclopentyloxyphenyl)methyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 51104170
1-[(2S)-2-aminopropanoyl]-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 119309414
N-[(3-cyclohexyloxyphenyl)methyl]cyclopentanecarboxamide
CID 86941906
1-N-cyclohexyl-4-N-[(4-methylphenyl)methyl]piperidine-1,4-dicarboxamide
CID 1083731

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide?
The IUPAC name of 1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide (CID 110793800) is 1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide is CC(=O)N1CCC(C(=O)NCc2ccc(OC3CCCC3)cc2)CC1.
What is the InChIKey of 1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide?
The InChIKey is POIVEJWFAWEJFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O3/c1-15(23)22-12-10-17(11-13-22)20(24)21-14-16-6-8-19(9-7-16)25-18-4-2-3-5-18/h6-9,17-18H,2-5,10-14H2,1H3,(H,21,24).
What are the key properties of 1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide?
1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide has a molecular weight of 344.45 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-[(4-cyclopentyloxyphenyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 110793800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).