methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate

C15H20N2O3 — CID 115536075

IUPACmethyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate
SMILESCOC(=O)CN(C(=O)Nc1ccccc1)C1CCCC1
InChIInChI=1S/C15H20N2O3/c1-20-14(18)11-17(13-9-5-6-10-13)15(19)16-12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-11H2,1H3,(H,16,19)
InChIKeyOAOZAYYAOUZQDD-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.64
Rot. Bonds4

About methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate

methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate (PubChem CID 115536075) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate
PubChem CID115536075
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Namemethyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate
SMILESCOC(=O)CN(C(=O)Nc1ccccc1)C1CCCC1
InChIInChI=1S/C15H20N2O3/c1-20-14(18)11-17(13-9-5-6-10-13)15(19)16-12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-11H2,1H3,(H,16,19)
InChIKeyOAOZAYYAOUZQDD-UHFFFAOYSA-N
XLogP2.64
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[cyclopentyl-(2-phenylsulfanylacetyl)amino]acetate
CID 80718069
1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea
CID 43319508
2-[cycloheptyl(methyl)amino]-N-phenylacetamide
CID 16577724
1-cyclohexyl-1-hydroxy-3-phenylurea
CID 86182203
1-[(4-chlorophenyl)methyl]-1-cyclopentyl-3-phenylurea
CID 67700978
1-[(2-chlorophenyl)methyl]-1-cyclopentyl-3-phenylurea
CID 151779518
1-cyclohexyl-3-(4-methylphenyl)-1-[(E)-2-methyl-3-phenylprop-2-enyl]urea
CID 42697658
methyl 2-[acetyl(cyclopentyl)amino]acetate
CID 80709615
methyl 3-[cyclohexyl-[(4-propan-2-ylphenyl)carbamoyl]amino]propanoate
CID 42697074
1-cyclopentyl-3-phenyl-1-[[4-(trifluoromethoxy)phenyl]methyl]urea
CID 13201307
1-cyclopentyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenylurea
CID 652123
1-cyclopentyl-3-phenyl-1-(1,3-thiazol-2-ylmethyl)urea
CID 150356043

Frequently Asked Questions

What is the IUPAC name of methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate?
The IUPAC name of methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate (CID 115536075) is methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate.
What is the SMILES notation for methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate?
The canonical SMILES for methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate is COC(=O)CN(C(=O)Nc1ccccc1)C1CCCC1.
What is the InChIKey of methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate?
The InChIKey is OAOZAYYAOUZQDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-20-14(18)11-17(13-9-5-6-10-13)15(19)16-12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-11H2,1H3,(H,16,19).
What are the key properties of methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate?
methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate has a molecular weight of 276.34 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[cyclopentyl(phenylcarbamoyl)amino]acetate is sourced from PubChem (CID 115536075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).