[4-(3-amino-1H-indol-5-yl)phenyl]methanol

C15H14N2O — CID 70796369

IUPAC[4-(3-amino-1H-indol-5-yl)phenyl]methanol
SMILESNc1c[nH]c2ccc(-c3ccc(CO)cc3)cc12
InChIInChI=1S/C15H14N2O/c16-14-8-17-15-6-5-12(7-13(14)15)11-3-1-10(9-18)2-4-11/h1-8,17-18H,9,16H2
InChIKeyBUNAKNFOFKPFDN-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.91
Rot. Bonds2

About [4-(3-amino-1H-indol-5-yl)phenyl]methanol

[4-(3-amino-1H-indol-5-yl)phenyl]methanol (PubChem CID 70796369) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is [4-(3-amino-1H-indol-5-yl)phenyl]methanol.

Molecular Properties

Compound Name[4-(3-amino-1H-indol-5-yl)phenyl]methanol
PubChem CID70796369
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name[4-(3-amino-1H-indol-5-yl)phenyl]methanol
SMILESNc1c[nH]c2ccc(-c3ccc(CO)cc3)cc12
InChIInChI=1S/C15H14N2O/c16-14-8-17-15-6-5-12(7-13(14)15)11-3-1-10(9-18)2-4-11/h1-8,17-18H,9,16H2
InChIKeyBUNAKNFOFKPFDN-UHFFFAOYSA-N
XLogP2.91
TPSA62.04 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(3-amino-1H-indol-5-yl)phenyl]methanol?
The IUPAC name of [4-(3-amino-1H-indol-5-yl)phenyl]methanol (CID 70796369) is [4-(3-amino-1H-indol-5-yl)phenyl]methanol.
What is the SMILES notation for [4-(3-amino-1H-indol-5-yl)phenyl]methanol?
The canonical SMILES for [4-(3-amino-1H-indol-5-yl)phenyl]methanol is Nc1c[nH]c2ccc(-c3ccc(CO)cc3)cc12.
What is the InChIKey of [4-(3-amino-1H-indol-5-yl)phenyl]methanol?
The InChIKey is BUNAKNFOFKPFDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c16-14-8-17-15-6-5-12(7-13(14)15)11-3-1-10(9-18)2-4-11/h1-8,17-18H,9,16H2.
What are the key properties of [4-(3-amino-1H-indol-5-yl)phenyl]methanol?
[4-(3-amino-1H-indol-5-yl)phenyl]methanol has a molecular weight of 238.29 g/mol, XLogP of 2.91, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-amino-1H-indol-5-yl)phenyl]methanol is sourced from PubChem (CID 70796369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).