(3-cyclopropylphenyl)-(1H-indol-5-yl)methanol

C18H17NO — CID 81437598

IUPAC(3-cyclopropylphenyl)-(1H-indol-5-yl)methanol
SMILESOC(c1cccc(C2CC2)c1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C18H17NO/c20-18(15-3-1-2-13(10-15)12-4-5-12)16-6-7-17-14(11-16)8-9-19-17/h1-3,6-12,18-20H,4-5H2
InChIKeySAAJUOCWGFEULO-UHFFFAOYSA-N
MW263.34 g/mol
LogP4.13
Rot. Bonds3

About (3-cyclopropylphenyl)-(1H-indol-5-yl)methanol

(3-cyclopropylphenyl)-(1H-indol-5-yl)methanol (PubChem CID 81437598) has the molecular formula C18H17NO and a molecular weight of 263.34 g/mol. Its IUPAC name is (3-cyclopropylphenyl)-(1H-indol-5-yl)methanol.

Molecular Properties

Compound Name(3-cyclopropylphenyl)-(1H-indol-5-yl)methanol
PubChem CID81437598
Molecular FormulaC18H17NO
Molecular Weight263.34 g/mol
Exact Mass263.13
IUPAC Name(3-cyclopropylphenyl)-(1H-indol-5-yl)methanol
SMILESOC(c1cccc(C2CC2)c1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C18H17NO/c20-18(15-3-1-2-13(10-15)12-4-5-12)16-6-7-17-14(11-16)8-9-19-17/h1-3,6-12,18-20H,4-5H2
InChIKeySAAJUOCWGFEULO-UHFFFAOYSA-N
XLogP4.13
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1H-indol-5-yl(phenyl)methanol
CID 19042833
1H-indol-5-yl-(3-methoxyphenyl)methanol
CID 81444817
(4-chlorophenyl)-(3-cyclopropylphenyl)methanol
CID 79979843
(4-fluorophenyl)-(1H-indol-5-yl)methanol
CID 81444818
(3-cyclopropylphenyl)-(3,4-dichlorophenyl)methanol
CID 79980407
(3-cyclopropyloxyphenyl)-(3-cyclopropylphenyl)methanol
CID 114520953
1H-indol-5-yl-(3,4,5-trifluorophenyl)methanol
CID 81444552
(3-cyclopropylphenyl)-(3,4-dimethoxyphenyl)methanol
CID 79973193
(3-cyclopropylphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 107128110
5-(4-methylcyclohexyl)-1H-indole
CID 69051193
4-[hydroxy(1H-indol-5-yl)methyl]benzonitrile
CID 115480990
(3-cyclobutylphenyl)-(4-methoxyphenyl)methanol
CID 114601153

Frequently Asked Questions

What is the IUPAC name of (3-cyclopropylphenyl)-(1H-indol-5-yl)methanol?
The IUPAC name of (3-cyclopropylphenyl)-(1H-indol-5-yl)methanol (CID 81437598) is (3-cyclopropylphenyl)-(1H-indol-5-yl)methanol.
What is the SMILES notation for (3-cyclopropylphenyl)-(1H-indol-5-yl)methanol?
The canonical SMILES for (3-cyclopropylphenyl)-(1H-indol-5-yl)methanol is OC(c1cccc(C2CC2)c1)c1ccc2[nH]ccc2c1.
What is the InChIKey of (3-cyclopropylphenyl)-(1H-indol-5-yl)methanol?
The InChIKey is SAAJUOCWGFEULO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO/c20-18(15-3-1-2-13(10-15)12-4-5-12)16-6-7-17-14(11-16)8-9-19-17/h1-3,6-12,18-20H,4-5H2.
What are the key properties of (3-cyclopropylphenyl)-(1H-indol-5-yl)methanol?
(3-cyclopropylphenyl)-(1H-indol-5-yl)methanol has a molecular weight of 263.34 g/mol, XLogP of 4.13, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropylphenyl)-(1H-indol-5-yl)methanol is sourced from PubChem (CID 81437598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).