1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide

C24H27N3O2 — CID 154850178

IUPAC1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide
SMILESCN(C(=O)Cn1cc(C(N)=O)c2ccccc21)C1CCCCC1c1ccccc1
InChIInChI=1S/C24H27N3O2/c1-26(21-13-7-5-11-18(21)17-9-3-2-4-10-17)23(28)16-27-15-20(24(25)29)19-12-6-8-14-22(19)27/h2-4,6,8-10,12,14-15,18,21H,5,7,11,13,16H2,1H3,(H2,25,29)
InChIKeySJFDPFVRCJIGHV-UHFFFAOYSA-N
MW389.50 g/mol
LogP3.92
Rot. Bonds5

About 1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide

1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide (PubChem CID 154850178) has the molecular formula C24H27N3O2 and a molecular weight of 389.50 g/mol. Its IUPAC name is 1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide.

Molecular Properties

Compound Name1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide
PubChem CID154850178
Molecular FormulaC24H27N3O2
Molecular Weight389.50 g/mol
Exact Mass389.21
IUPAC Name1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide
SMILESCN(C(=O)Cn1cc(C(N)=O)c2ccccc21)C1CCCCC1c1ccccc1
InChIInChI=1S/C24H27N3O2/c1-26(21-13-7-5-11-18(21)17-9-3-2-4-10-17)23(28)16-27-15-20(24(25)29)19-12-6-8-14-22(19)27/h2-4,6,8-10,12,14-15,18,21H,5,7,11,13,16H2,1H3,(H2,25,29)
InChIKeySJFDPFVRCJIGHV-UHFFFAOYSA-N
XLogP3.92
TPSA68.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-(methylsulfamoyl)-N-(2-phenylcyclohexyl)acetamide
CID 126827812
1-[2-[cyclopropyl(methyl)amino]-2-oxoethyl]indole-4-carboxylic acid
CID 61489506
2-[3-(cyclopropanecarbonyl)indol-1-yl]-N-methyl-N-phenylacetamide
CID 21370258
2-[3-(benzenesulfonyl)indol-1-yl]-N-cyclohexyl-N-methylacetamide
CID 16935293
1-[2-[ethyl(methyl)amino]-2-oxoethyl]indole-3-carboxylic acid
CID 43309799
N,N-dimethyl-2-phenylcyclohexan-1-amine
CID 14946175
1-(2-hydroxyethyl)indole-3-carboxamide
CID 172792494
2-[1-[2-(diethylamino)-2-oxoethyl]indol-3-yl]-N,N-dimethyl-2-oxoacetamide
CID 4248907
1-[2-[(3aS,7aR)-1,3,3a,4,7,7a-hexahydroisoindol-2-yl]-2-oxoethyl]indole-3-carboxamide
CID 56878336
2-[(3R,4R)-3-(aminomethyl)-4-phenylpyrrolidin-1-yl]-N-methyl-N-(2-methylcyclohexyl)acetamide;hydrochloride
CID 120760140
1-[2-(3-cyclopropyl-3-methylmorpholin-4-yl)-2-oxoethyl]indole-3-carboxamide
CID 136567884
2-[3-(benzenesulfonyl)indol-1-yl]-N-methyl-N-(1-methylpiperidin-4-yl)acetamide
CID 16935299

Frequently Asked Questions

What is the IUPAC name of 1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide?
The IUPAC name of 1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide (CID 154850178) is 1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide.
What is the SMILES notation for 1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide?
The canonical SMILES for 1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide is CN(C(=O)Cn1cc(C(N)=O)c2ccccc21)C1CCCCC1c1ccccc1.
What is the InChIKey of 1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide?
The InChIKey is SJFDPFVRCJIGHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O2/c1-26(21-13-7-5-11-18(21)17-9-3-2-4-10-17)23(28)16-27-15-20(24(25)29)19-12-6-8-14-22(19)27/h2-4,6,8-10,12,14-15,18,21H,5,7,11,13,16H2,1H3,(H2,25,29).
What are the key properties of 1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide?
1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide has a molecular weight of 389.50 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[methyl-(2-phenylcyclohexyl)amino]-2-oxoethyl]indole-3-carboxamide is sourced from PubChem (CID 154850178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).