3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide

C30H37N3O3 — CID 69448030

IUPAC3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide
SMILESCC(C)NC(=O)c1ccc2c(C3CCCCC3)c(-c3ccccc3)n(CC(=O)C3CNCCO3)c2c1
InChIInChI=1S/C30H37N3O3/c1-20(2)32-30(35)23-13-14-24-25(17-23)33(19-26(34)27-18-31-15-16-36-27)29(22-11-7-4-8-12-22)28(24)21-9-5-3-6-10-21/h4,7-8,11-14,17,20-21,27,31H,3,5-6,9-10,15-16,18-19H2,1-2H3,(H,32,35)
InChIKeyFHOWLRJXHHQPIA-UHFFFAOYSA-N
MW487.64 g/mol
LogP5.05
Rot. Bonds7

About 3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide

3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide (PubChem CID 69448030) has the molecular formula C30H37N3O3 and a molecular weight of 487.64 g/mol. Its IUPAC name is 3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide.

Molecular Properties

Compound Name3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide
PubChem CID69448030
Molecular FormulaC30H37N3O3
Molecular Weight487.64 g/mol
Exact Mass487.28
IUPAC Name3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide
SMILESCC(C)NC(=O)c1ccc2c(C3CCCCC3)c(-c3ccccc3)n(CC(=O)C3CNCCO3)c2c1
InChIInChI=1S/C30H37N3O3/c1-20(2)32-30(35)23-13-14-24-25(17-23)33(19-26(34)27-18-31-15-16-36-27)29(22-11-7-4-8-12-22)28(24)21-9-5-3-6-10-21/h4,7-8,11-14,17,20-21,27,31H,3,5-6,9-10,15-16,18-19H2,1-2H3,(H,32,35)
InChIKeyFHOWLRJXHHQPIA-UHFFFAOYSA-N
XLogP5.05
TPSA72.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.64
LogP ≤ 55.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-benzyl-3-cyclohexyl-1-(2-morpholin-4-yl-2-oxoethyl)-2-phenylindole-6-carboxamide
CID 58923431
3-cyclohexyl-1-[2-(ethenylamino)-2-oxoethyl]-2-phenylindole-6-carboxylic acid
CID 11211801
3-cyclohexyl-N-[(1-methylpiperidin-3-yl)methyl]-1-(2-morpholin-4-yl-2-oxoethyl)-2-phenylindole-6-carboxamide
CID 11455732
3-cyclohexyl-1-[2-oxo-2-(prop-2-enylamino)ethyl]-2-phenylindole-6-carboxylic acid
CID 58923486
3-cyclohexyl-1-[2-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-2-oxoethyl]-2-phenylindole-6-carboxylic acid
CID 69441984
3-cyclopentyl-1-[2-oxo-2-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]-2-phenylindole-6-carboxylic acid
CID 11156284
2-[(13-cyclohexyl-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carbonyl)amino]-3-(dimethylamino)propanoic acid
CID 23152341
3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-2-(3-hydroxyphenyl)indole-6-carboxylic acid
CID 58923454
3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-2-(3-methoxyphenyl)indole-6-carboxylic acid
CID 58923491
3-cyclohexyl-2-phenyl-1-(pyridin-3-ylmethyl)indole-6-carboxylic acid
CID 11178349
2-[3-cyclohexyl-6-(2-ethylsulfonylacetyl)-2-phenylindol-1-yl]-1-[4-(dimethylamino)piperidin-1-yl]ethanone
CID 58923420
3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-2-pyridin-3-ylindole-6-carboxylic acid
CID 6480928

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide?
The IUPAC name of 3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide (CID 69448030) is 3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide.
What is the SMILES notation for 3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide?
The canonical SMILES for 3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide is CC(C)NC(=O)c1ccc2c(C3CCCCC3)c(-c3ccccc3)n(CC(=O)C3CNCCO3)c2c1.
What is the InChIKey of 3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide?
The InChIKey is FHOWLRJXHHQPIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H37N3O3/c1-20(2)32-30(35)23-13-14-24-25(17-23)33(19-26(34)27-18-31-15-16-36-27)29(22-11-7-4-8-12-22)28(24)21-9-5-3-6-10-21/h4,7-8,11-14,17,20-21,27,31H,3,5-6,9-10,15-16,18-19H2,1-2H3,(H,32,35).
What are the key properties of 3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide?
3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide has a molecular weight of 487.64 g/mol, XLogP of 5.05, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-1-(2-morpholin-2-yl-2-oxoethyl)-2-phenyl-N-propan-2-ylindole-6-carboxamide is sourced from PubChem (CID 69448030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).