N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide

C21H25N3O3 — CID 55993011

IUPACN-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide
SMILESCc1cccc(NC(=O)NCC(=O)Nc2ccccc2OC2CCCC2)c1
InChIInChI=1S/C21H25N3O3/c1-15-7-6-8-16(13-15)23-21(26)22-14-20(25)24-18-11-4-5-12-19(18)27-17-9-2-3-10-17/h4-8,11-13,17H,2-3,9-10,14H2,1H3,(H,24,25)(H2,22,23,26)
InChIKeyHCHNPTSDEJGJEN-UHFFFAOYSA-N
MW367.45 g/mol
LogP4.08
Rot. Bonds6

About N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide

N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide (PubChem CID 55993011) has the molecular formula C21H25N3O3 and a molecular weight of 367.45 g/mol. Its IUPAC name is N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide.

Molecular Properties

Compound NameN-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide
PubChem CID55993011
Molecular FormulaC21H25N3O3
Molecular Weight367.45 g/mol
Exact Mass367.19
IUPAC NameN-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide
SMILESCc1cccc(NC(=O)NCC(=O)Nc2ccccc2OC2CCCC2)c1
InChIInChI=1S/C21H25N3O3/c1-15-7-6-8-16(13-15)23-21(26)22-14-20(25)24-18-11-4-5-12-19(18)27-17-9-2-3-10-17/h4-8,11-13,17H,2-3,9-10,14H2,1H3,(H,24,25)(H2,22,23,26)
InChIKeyHCHNPTSDEJGJEN-UHFFFAOYSA-N
XLogP4.08
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 54.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chlorophenyl)-2-(2-cyclopentyloxyanilino)acetamide
CID 52704421
methyl 4-[[2-(2-cyclopentyloxyanilino)acetyl]amino]benzoate
CID 60536886
N-[2-(2,3-dihydroindol-1-yl)phenyl]-2-[(3-methylphenyl)carbamoylamino]acetamide
CID 52710884
2-(4-bromophenyl)-N-(2-cyclopentyloxyphenyl)acetamide
CID 55807841
N-(3-fluorophenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide
CID 772239
1-[[(1S,2R)-2-hydroxycyclohexyl]methyl]-3-(3-methylphenyl)urea
CID 95634979
2-[(3-methylphenyl)carbamoylamino]acetamide
CID 47122532
1-[2-(cyclopropylamino)ethyl]-3-(3-methylphenyl)urea
CID 62663674
2-(cyclohexylcarbamoylamino)-N-(2-ethoxyphenyl)acetamide
CID 112998805
1-[(3-methylphenyl)methyl]-3-[2-(1-prop-2-enoylpiperidin-4-yl)oxyphenyl]urea
CID 172887559
N-cyclohexyl-N-[2-[[2-(3-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]benzamide
CID 4183323
2-[(3,4-difluorophenyl)carbamoylamino]-N-(3-methylphenyl)acetamide
CID 42663674

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide?
The IUPAC name of N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide (CID 55993011) is N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide.
What is the SMILES notation for N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide?
The canonical SMILES for N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide is Cc1cccc(NC(=O)NCC(=O)Nc2ccccc2OC2CCCC2)c1.
What is the InChIKey of N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide?
The InChIKey is HCHNPTSDEJGJEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O3/c1-15-7-6-8-16(13-15)23-21(26)22-14-20(25)24-18-11-4-5-12-19(18)27-17-9-2-3-10-17/h4-8,11-13,17H,2-3,9-10,14H2,1H3,(H,24,25)(H2,22,23,26).
What are the key properties of N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide?
N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide has a molecular weight of 367.45 g/mol, XLogP of 4.08, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyloxyphenyl)-2-[(3-methylphenyl)carbamoylamino]acetamide is sourced from PubChem (CID 55993011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).