2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole

C15H21N — CID 174599108

IUPAC2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole
SMILESCC1C=C2C=C(C3CCCCC3)N=C2CC1
InChIInChI=1S/C15H21N/c1-11-7-8-14-13(9-11)10-15(16-14)12-5-3-2-4-6-12/h9-12H,2-8H2,1H3
InChIKeyNEWHNIZENGASTM-UHFFFAOYSA-N
MW215.34 g/mol
LogP4.26
Rot. Bonds1

About 2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole

2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole (PubChem CID 174599108) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole.

Molecular Properties

Compound Name2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole
PubChem CID174599108
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole
SMILESCC1C=C2C=C(C3CCCCC3)N=C2CC1
InChIInChI=1S/C15H21N/c1-11-7-8-14-13(9-11)10-15(16-14)12-5-3-2-4-6-12/h9-12H,2-8H2,1H3
InChIKeyNEWHNIZENGASTM-UHFFFAOYSA-N
XLogP4.26
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole?
The IUPAC name of 2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole (CID 174599108) is 2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole.
What is the SMILES notation for 2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole?
The canonical SMILES for 2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole is CC1C=C2C=C(C3CCCCC3)N=C2CC1.
What is the InChIKey of 2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole?
The InChIKey is NEWHNIZENGASTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-11-7-8-14-13(9-11)10-15(16-14)12-5-3-2-4-6-12/h9-12H,2-8H2,1H3.
What are the key properties of 2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole?
2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole has a molecular weight of 215.34 g/mol, XLogP of 4.26, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-methyl-6,7-dihydro-5H-indole is sourced from PubChem (CID 174599108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).