N',N'-dibenzyl-N-cyclopentyloxamide

C21H24N2O2 — CID 108505966

IUPACN',N'-dibenzyl-N-cyclopentyloxamide
SMILESO=C(NC1CCCC1)C(=O)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C21H24N2O2/c24-20(22-19-13-7-8-14-19)21(25)23(15-17-9-3-1-4-10-17)16-18-11-5-2-6-12-18/h1-6,9-12,19H,7-8,13-16H2,(H,22,24)
InChIKeyOGRMIWFQYHLIMO-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.27
Rot. Bonds5

About N',N'-dibenzyl-N-cyclopentyloxamide

N',N'-dibenzyl-N-cyclopentyloxamide (PubChem CID 108505966) has the molecular formula C21H24N2O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is N',N'-dibenzyl-N-cyclopentyloxamide.

Molecular Properties

Compound NameN',N'-dibenzyl-N-cyclopentyloxamide
PubChem CID108505966
Molecular FormulaC21H24N2O2
Molecular Weight336.44 g/mol
Exact Mass336.18
IUPAC NameN',N'-dibenzyl-N-cyclopentyloxamide
SMILESO=C(NC1CCCC1)C(=O)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C21H24N2O2/c24-20(22-19-13-7-8-14-19)21(25)23(15-17-9-3-1-4-10-17)16-18-11-5-2-6-12-18/h1-6,9-12,19H,7-8,13-16H2,(H,22,24)
InChIKeyOGRMIWFQYHLIMO-UHFFFAOYSA-N
XLogP3.27
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

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CID 108517350
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N-cyclopentyl-2-phenylacetamide;hydrochloride
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1-benzyl-3-cyclohexyl-1-phenylurea
CID 602977
1-benzyl-1-(2-cyanoethyl)-3-cyclohexylurea
CID 4685266
benzyl(cyclohexylmethyl)carbamic acid
CID 57063774
N'-benzyl-N-cyclopentyl-N'-methylpropanediamide
CID 108942140
2-[benzyl(methyl)amino]-N-cyclohexylacetamide
CID 54808837
1-benzyl-3-cyclohexyl-1-ethylthiourea
CID 5098448
methyl 3-[benzyl(cyclohexylcarbamoyl)amino]propanoate
CID 42697991
N-(1,3-benzodioxol-5-yl)-N'-benzyl-N'-[2-(cyclohexylamino)-2-oxoethyl]oxamide
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2-(benzylamino)-N-cyclohexyl-2-sulfanylideneacetamide
CID 2976790

Frequently Asked Questions

What is the IUPAC name of N',N'-dibenzyl-N-cyclopentyloxamide?
The IUPAC name of N',N'-dibenzyl-N-cyclopentyloxamide (CID 108505966) is N',N'-dibenzyl-N-cyclopentyloxamide.
What is the SMILES notation for N',N'-dibenzyl-N-cyclopentyloxamide?
The canonical SMILES for N',N'-dibenzyl-N-cyclopentyloxamide is O=C(NC1CCCC1)C(=O)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N',N'-dibenzyl-N-cyclopentyloxamide?
The InChIKey is OGRMIWFQYHLIMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O2/c24-20(22-19-13-7-8-14-19)21(25)23(15-17-9-3-1-4-10-17)16-18-11-5-2-6-12-18/h1-6,9-12,19H,7-8,13-16H2,(H,22,24).
What are the key properties of N',N'-dibenzyl-N-cyclopentyloxamide?
N',N'-dibenzyl-N-cyclopentyloxamide has a molecular weight of 336.44 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dibenzyl-N-cyclopentyloxamide is sourced from PubChem (CID 108505966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).