2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide

C20H30N4O3 — CID 27221599

IUPAC2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide
SMILESCCCN(CC(=O)NC(=O)NC1CCCC1)CC(=O)Nc1ccccc1C
InChIInChI=1S/C20H30N4O3/c1-3-12-24(13-18(25)22-17-11-7-4-8-15(17)2)14-19(26)23-20(27)21-16-9-5-6-10-16/h4,7-8,11,16H,3,5-6,9-10,12-14H2,1-2H3,(H,22,25)(H2,21,23,26,27)
InChIKeyNGEFPRZXIZRZKU-UHFFFAOYSA-N
MW374.49 g/mol
LogP2.41
Rot. Bonds8

About 2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide

2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide (PubChem CID 27221599) has the molecular formula C20H30N4O3 and a molecular weight of 374.49 g/mol. Its IUPAC name is 2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide
PubChem CID27221599
Molecular FormulaC20H30N4O3
Molecular Weight374.49 g/mol
Exact Mass374.23
IUPAC Name2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide
SMILESCCCN(CC(=O)NC(=O)NC1CCCC1)CC(=O)Nc1ccccc1C
InChIInChI=1S/C20H30N4O3/c1-3-12-24(13-18(25)22-17-11-7-4-8-15(17)2)14-19(26)23-20(27)21-16-9-5-6-10-16/h4,7-8,11,16H,3,5-6,9-10,12-14H2,1-2H3,(H,22,25)(H2,21,23,26,27)
InChIKeyNGEFPRZXIZRZKU-UHFFFAOYSA-N
XLogP2.41
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-ethylpiperidin-4-yl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide
CID 78816923
N-cyclopentyl-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]propanamide
CID 78789589
N-cyclooctyl-2-[[2-(2-methoxyanilino)-2-oxoethyl]-propylamino]acetamide
CID 27098874
2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-phenylacetamide
CID 9038815
2-[[2-(cyclopropylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2,3,4-trifluorophenyl)acetamide
CID 27104198
2-[[2-[methyl-(4-methylcyclohexyl)amino]-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide
CID 78816919
2-[[2-[2-[(2R)-butan-2-yl]anilino]-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide
CID 9038968
N-cyclohexyl-N'-(2-methylphenyl)propanediamide
CID 108942579
2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-prop-2-ynylacetamide
CID 8810170
N-(4-chlorophenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide
CID 9038956
2-(dibutylamino)-N-(2-methylphenyl)acetamide;hydrochloride
CID 3026049
2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide
CID 16577693

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide (CID 27221599) is 2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide is CCCN(CC(=O)NC(=O)NC1CCCC1)CC(=O)Nc1ccccc1C.
What is the InChIKey of 2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide?
The InChIKey is NGEFPRZXIZRZKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O3/c1-3-12-24(13-18(25)22-17-11-7-4-8-15(17)2)14-19(26)23-20(27)21-16-9-5-6-10-16/h4,7-8,11,16H,3,5-6,9-10,12-14H2,1-2H3,(H,22,25)(H2,21,23,26,27).
What are the key properties of 2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide?
2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide has a molecular weight of 374.49 g/mol, XLogP of 2.41, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 27221599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).