4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole

C19H19N — CID 58028341

IUPAC4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole
SMILESCc1cc(C)cc(-n2c3c(c4ccccc42)CCC3)c1
InChIInChI=1S/C19H19N/c1-13-10-14(2)12-15(11-13)20-18-8-4-3-6-16(18)17-7-5-9-19(17)20/h3-4,6,8,10-12H,5,7,9H2,1-2H3
InChIKeyVWRLAIAQNMKKJM-UHFFFAOYSA-N
MW261.37 g/mol
LogP4.74
Rot. Bonds1

About 4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole

4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole (PubChem CID 58028341) has the molecular formula C19H19N and a molecular weight of 261.37 g/mol. Its IUPAC name is 4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole.

Molecular Properties

Compound Name4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole
PubChem CID58028341
Molecular FormulaC19H19N
Molecular Weight261.37 g/mol
Exact Mass261.15
IUPAC Name4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole
SMILESCc1cc(C)cc(-n2c3c(c4ccccc42)CCC3)c1
InChIInChI=1S/C19H19N/c1-13-10-14(2)12-15(11-13)20-18-8-4-3-6-16(18)17-7-5-9-19(17)20/h3-4,6,8,10-12H,5,7,9H2,1-2H3
InChIKeyVWRLAIAQNMKKJM-UHFFFAOYSA-N
XLogP4.74
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-(4-chlorophenyl)-1,2,3,4-tetrahydrocarbazole
CID 812920
9-[2-(1,1-difluoroethyl)-4-methylphenyl]-1,2,3,4-tetrahydrocarbazole
CID 138526952
4-(1,2,3,4-tetrahydrocarbazol-9-yl)benzonitrile
CID 69192503
4-(1H-inden-1-id-2-yl)-2,3-dihydro-1H-cyclopenta[b]indole;zirconium(3+);dichloride
CID 87935175
6-[3,5-bis(9-phenyl-5,6,7,8-tetrahydrocarbazol-3-yl)phenyl]-9-phenyl-1,2,3,4-tetrahydrocarbazole
CID 58663485
9-(3-carbazol-9-yl-5-methylphenyl)-3,6-diphenylcarbazole
CID 145158092
14-(3-carbazol-9-ylphenyl)-9-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20)-heptaene
CID 90055350
5-[4-(3,5-diphenylpyrazol-1-yl)phenyl]-6,7,8,9,10,11-hexahydrocycloocta[b]indole
CID 58663550
9-iodo-1,2,3,4-tetrahydrocarbazole
CID 146323792
10-(4-chlorophenyl)-1,2,3,4-tetrahydroacridin-9-one
CID 165354564
5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenyl-8,9,10,11-tetrahydroindolo[2,3-b]carbazole
CID 90055724
N'-(5-methylfuran-2-yl)-4-(1,2,3,4-tetrahydrocarbazol-9-yl)benzohydrazide
CID 132533900

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole?
The IUPAC name of 4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole (CID 58028341) is 4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole.
What is the SMILES notation for 4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole?
The canonical SMILES for 4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole is Cc1cc(C)cc(-n2c3c(c4ccccc42)CCC3)c1.
What is the InChIKey of 4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole?
The InChIKey is VWRLAIAQNMKKJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N/c1-13-10-14(2)12-15(11-13)20-18-8-4-3-6-16(18)17-7-5-9-19(17)20/h3-4,6,8,10-12H,5,7,9H2,1-2H3.
What are the key properties of 4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole?
4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole has a molecular weight of 261.37 g/mol, XLogP of 4.74, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylphenyl)-2,3-dihydro-1H-cyclopenta[b]indole is sourced from PubChem (CID 58028341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).