3-cyclohexyl-1-phenyl-2-propan-2-ylindole

C23H27N — CID 102225652

IUPAC3-cyclohexyl-1-phenyl-2-propan-2-ylindole
SMILESCC(C)c1c(C2CCCCC2)c2ccccc2n1-c1ccccc1
InChIInChI=1S/C23H27N/c1-17(2)23-22(18-11-5-3-6-12-18)20-15-9-10-16-21(20)24(23)19-13-7-4-8-14-19/h4,7-10,13-18H,3,5-6,11-12H2,1-2H3
InChIKeyBQCSAMRGLILAKR-UHFFFAOYSA-N
MW317.48 g/mol
LogP6.80
Rot. Bonds3

About 3-cyclohexyl-1-phenyl-2-propan-2-ylindole

3-cyclohexyl-1-phenyl-2-propan-2-ylindole (PubChem CID 102225652) has the molecular formula C23H27N and a molecular weight of 317.48 g/mol. Its IUPAC name is 3-cyclohexyl-1-phenyl-2-propan-2-ylindole.

Molecular Properties

Compound Name3-cyclohexyl-1-phenyl-2-propan-2-ylindole
PubChem CID102225652
Molecular FormulaC23H27N
Molecular Weight317.48 g/mol
Exact Mass317.21
IUPAC Name3-cyclohexyl-1-phenyl-2-propan-2-ylindole
SMILESCC(C)c1c(C2CCCCC2)c2ccccc2n1-c1ccccc1
InChIInChI=1S/C23H27N/c1-17(2)23-22(18-11-5-3-6-12-18)20-15-9-10-16-21(20)24(23)19-13-7-4-8-14-19/h4,7-10,13-18H,3,5-6,11-12H2,1-2H3
InChIKeyBQCSAMRGLILAKR-UHFFFAOYSA-N
XLogP6.80
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500317.48
LogP ≤ 56.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-cyclohexyl-1-phenyl-2-propan-2-ylindole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-cyclohexyl-1-phenylquinolin-4-one
CID 59052660
cyclohexyl-diphenyl-(9-phenylcarbazol-3-yl)silane
CID 158356675
N-[4-[1-[4-(N-(4-cyclohexylphenyl)anilino)phenyl]ethyl]phenyl]-N,9-diphenylcarbazol-2-amine
CID 168810700
9-(3-cyclopentylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 168805817
1,3-dicyclohexyl-5-phenyl-2,4,6-tri(propan-2-yl)benzene
CID 175032315
9-propan-2-yl-9,12-diazatetracyclo[10.3.2.02,10.03,8]heptadeca-2(10),3,5,7-tetraene
CID 130265724
2-benzhydryl-1,3-diphenylindole
CID 102040696
[3-[3-[2-(3-cyclohexylcarbazol-9-yl)carbazol-9-yl]phenyl]phenyl]-triphenylsilane
CID 176779818
3-[9-[4-(3-pentacyclo[10.2.2.25,8.02,11.04,9]octadeca-2(11),3,9-trienyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 177145381
3-[9-[4-(3-cyclopentyl-10-phenylanthracen-9-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole;2-(9-phenylcarbazol-3-yl)-9-[4-(10-phenyl-3-propan-2-ylanthracen-9-yl)phenyl]carbazole;2-(9-phenylcarbazol-3-yl)-9-[4-(10-phenyl-3-propylanthracen-9-yl)phenyl]carbazole
CID 161395291
2-(3-cyclohexyl-2-phenylindol-1-yl)-1-(dimethylamino)ethanol
CID 141127629
4-[3-(4-cyanophenyl)-2,5-dicyclohexyl-4,6-bis(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzonitrile
CID 148640902

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-1-phenyl-2-propan-2-ylindole?
The IUPAC name of 3-cyclohexyl-1-phenyl-2-propan-2-ylindole (CID 102225652) is 3-cyclohexyl-1-phenyl-2-propan-2-ylindole.
What is the SMILES notation for 3-cyclohexyl-1-phenyl-2-propan-2-ylindole?
The canonical SMILES for 3-cyclohexyl-1-phenyl-2-propan-2-ylindole is CC(C)c1c(C2CCCCC2)c2ccccc2n1-c1ccccc1.
What is the InChIKey of 3-cyclohexyl-1-phenyl-2-propan-2-ylindole?
The InChIKey is BQCSAMRGLILAKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N/c1-17(2)23-22(18-11-5-3-6-12-18)20-15-9-10-16-21(20)24(23)19-13-7-4-8-14-19/h4,7-10,13-18H,3,5-6,11-12H2,1-2H3.
What are the key properties of 3-cyclohexyl-1-phenyl-2-propan-2-ylindole?
3-cyclohexyl-1-phenyl-2-propan-2-ylindole has a molecular weight of 317.48 g/mol, XLogP of 6.80, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-1-phenyl-2-propan-2-ylindole is sourced from PubChem (CID 102225652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).