N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide

C20H30N2O3 — CID 84591482

IUPACN-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide
SMILESCC(O)C1CCCN(C(=O)NCc2cccc(OC3CCCC3)c2)C1
InChIInChI=1S/C20H30N2O3/c1-15(23)17-7-5-11-22(14-17)20(24)21-13-16-6-4-10-19(12-16)25-18-8-2-3-9-18/h4,6,10,12,15,17-18,23H,2-3,5,7-9,11,13-14H2,1H3,(H,21,24)
InChIKeyGADXKUUTSPIERD-UHFFFAOYSA-N
MW346.47 g/mol
LogP3.31
Rot. Bonds5

About N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide

N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide (PubChem CID 84591482) has the molecular formula C20H30N2O3 and a molecular weight of 346.47 g/mol. Its IUPAC name is N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide
PubChem CID84591482
Molecular FormulaC20H30N2O3
Molecular Weight346.47 g/mol
Exact Mass346.23
IUPAC NameN-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide
SMILESCC(O)C1CCCN(C(=O)NCc2cccc(OC3CCCC3)c2)C1
InChIInChI=1S/C20H30N2O3/c1-15(23)17-7-5-11-22(14-17)20(24)21-13-16-6-4-10-19(12-16)25-18-8-2-3-9-18/h4,6,10,12,15,17-18,23H,2-3,5,7-9,11,13-14H2,1H3,(H,21,24)
InChIKeyGADXKUUTSPIERD-UHFFFAOYSA-N
XLogP3.31
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(3-cyclohexyloxyphenyl)methyl]-4-ethylpiperazine-1-carboxamide
CID 86943869
4-(cyclohexanecarbonylamino)-N-[(3-cyclohexyloxyphenyl)methyl]piperidine-1-carboxamide
CID 86943396
1-[(3-cyclohexyloxyphenyl)methyl]-3-[1-(3-methylbutanoyl)piperidin-4-yl]urea
CID 86943213
3-(1-hydroxyethyl)-N-[(4-phenoxyphenyl)methyl]pyrrolidine-1-carboxamide
CID 75477203
1-[(3-methoxyphenyl)methylcarbamoyl]piperidine-3-carboxylic acid
CID 61029424
N-(3-cyclopentyloxyphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 111424820
N-(2,3-dihydro-1H-inden-5-ylmethyl)-3-(1-hydroxyethyl)pyrrolidine-1-carboxamide
CID 86788732
N-[(3-cyclohexyloxyphenyl)methyl]cyclopentanecarboxamide
CID 86941906
(3S)-N-[2-(3,5-dimethylphenoxy)ethyl]-3-[(1S)-1-hydroxyethyl]piperidine-1-carboxamide
CID 97238091
1-[(3-cyclohexyloxyphenyl)methyl]-3-[(2-methyl-1,2,4-triazol-3-yl)methyl]urea
CID 71990119
(3S)-3-(2,5-dihydropyrrol-1-yl)-N-[(3-propan-2-yloxyphenyl)methyl]pyrrolidine-1-carboxamide
CID 98203018
2-[(3-cyclopentyloxyphenyl)methylamino]hexanoic acid
CID 120510137

Frequently Asked Questions

What is the IUPAC name of N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide?
The IUPAC name of N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide (CID 84591482) is N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide?
The canonical SMILES for N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide is CC(O)C1CCCN(C(=O)NCc2cccc(OC3CCCC3)c2)C1.
What is the InChIKey of N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide?
The InChIKey is GADXKUUTSPIERD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O3/c1-15(23)17-7-5-11-22(14-17)20(24)21-13-16-6-4-10-19(12-16)25-18-8-2-3-9-18/h4,6,10,12,15,17-18,23H,2-3,5,7-9,11,13-14H2,1H3,(H,21,24).
What are the key properties of N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide?
N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide has a molecular weight of 346.47 g/mol, XLogP of 3.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-cyclopentyloxyphenyl)methyl]-3-(1-hydroxyethyl)piperidine-1-carboxamide is sourced from PubChem (CID 84591482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).