2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide

C22H31N3O2 — CID 55827499

IUPAC2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCC1CCC(N(CC(=O)Nc2ccccc2N2CCCC2=O)C2CC2)CC1
InChIInChI=1S/C22H31N3O2/c1-16-8-10-17(11-9-16)25(18-12-13-18)15-21(26)23-19-5-2-3-6-20(19)24-14-4-7-22(24)27/h2-3,5-6,16-18H,4,7-15H2,1H3,(H,23,26)
InChIKeyNMQPICCJCZLHSI-UHFFFAOYSA-N
MW369.51 g/mol
LogP3.80
Rot. Bonds6

About 2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide

2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide (PubChem CID 55827499) has the molecular formula C22H31N3O2 and a molecular weight of 369.51 g/mol. Its IUPAC name is 2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
PubChem CID55827499
Molecular FormulaC22H31N3O2
Molecular Weight369.51 g/mol
Exact Mass369.24
IUPAC Name2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCC1CCC(N(CC(=O)Nc2ccccc2N2CCCC2=O)C2CC2)CC1
InChIInChI=1S/C22H31N3O2/c1-16-8-10-17(11-9-16)25(18-12-13-18)15-21(26)23-19-5-2-3-6-20(19)24-14-4-7-22(24)27/h2-3,5-6,16-18H,4,7-15H2,1H3,(H,23,26)
InChIKeyNMQPICCJCZLHSI-UHFFFAOYSA-N
XLogP3.80
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.51
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclohexylmethyl(cyclopropyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 52678828
2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 17418944
2-cyclopentyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 51228887
2-(methylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide;hydrochloride
CID 119693883
2-[methyl-(4-methylcyclohexyl)amino]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 51286691
2-(4-hydroxypiperidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 41335965
N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide
CID 18166596
1-[2-[(2-methylcyclohexyl)amino]phenyl]pyrrolidin-2-one
CID 43107337
N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide
CID 26955397
N-[2-(2-oxopyrrolidin-1-yl)phenyl]-2-(prop-2-ynylamino)acetamide
CID 112722701
2-cyclopent-2-en-1-yl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 18166613
2-[(5-bromothiophen-2-yl)methyl-methylamino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 41374088

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The IUPAC name of 2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide (CID 55827499) is 2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The canonical SMILES for 2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide is CC1CCC(N(CC(=O)Nc2ccccc2N2CCCC2=O)C2CC2)CC1.
What is the InChIKey of 2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The InChIKey is NMQPICCJCZLHSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31N3O2/c1-16-8-10-17(11-9-16)25(18-12-13-18)15-21(26)23-19-5-2-3-6-20(19)24-14-4-7-22(24)27/h2-3,5-6,16-18H,4,7-15H2,1H3,(H,23,26).
What are the key properties of 2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide has a molecular weight of 369.51 g/mol, XLogP of 3.80, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-(4-methylcyclohexyl)amino]-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 55827499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).