4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol

C17H21NO — CID 69112846

IUPAC4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol
SMILESOC1CCC(c2c(C3CC3)[nH]c3ccccc23)CC1
InChIInChI=1S/C17H21NO/c19-13-9-7-11(8-10-13)16-14-3-1-2-4-15(14)18-17(16)12-5-6-12/h1-4,11-13,18-19H,5-10H2
InChIKeyHXJUYWWDBTWKFN-UHFFFAOYSA-N
MW255.36 g/mol
LogP4.06
Rot. Bonds2

About 4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol

4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol (PubChem CID 69112846) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol
PubChem CID69112846
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol
SMILESOC1CCC(c2c(C3CC3)[nH]c3ccccc23)CC1
InChIInChI=1S/C17H21NO/c19-13-9-7-11(8-10-13)16-14-3-1-2-4-15(14)18-17(16)12-5-6-12/h1-4,11-13,18-19H,5-10H2
InChIKeyHXJUYWWDBTWKFN-UHFFFAOYSA-N
XLogP4.06
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol?
The IUPAC name of 4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol (CID 69112846) is 4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol?
The canonical SMILES for 4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol is OC1CCC(c2c(C3CC3)[nH]c3ccccc23)CC1.
What is the InChIKey of 4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol?
The InChIKey is HXJUYWWDBTWKFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c19-13-9-7-11(8-10-13)16-14-3-1-2-4-15(14)18-17(16)12-5-6-12/h1-4,11-13,18-19H,5-10H2.
What are the key properties of 4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol?
4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol has a molecular weight of 255.36 g/mol, XLogP of 4.06, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopropyl-1H-indol-3-yl)cyclohexan-1-ol is sourced from PubChem (CID 69112846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).