1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol

C15H14N2O — CID 112742788

IUPAC1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol
SMILESCc1cc(C(O)c2c[nH]c3ccccc23)ccn1
InChIInChI=1S/C15H14N2O/c1-10-8-11(6-7-16-10)15(18)13-9-17-14-5-3-2-4-12(13)14/h2-9,15,17-18H,1H3
InChIKeyYKBIHTLUORJTAG-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.95
Rot. Bonds2

About 1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol

1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol (PubChem CID 112742788) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol.

Molecular Properties

Compound Name1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol
PubChem CID112742788
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol
SMILESCc1cc(C(O)c2c[nH]c3ccccc23)ccn1
InChIInChI=1S/C15H14N2O/c1-10-8-11(6-7-16-10)15(18)13-9-17-14-5-3-2-4-12(13)14/h2-9,15,17-18H,1H3
InChIKeyYKBIHTLUORJTAG-UHFFFAOYSA-N
XLogP2.95
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1R,2R)-2-(1H-indol-3-yl)-1,2-bis(4-methylphenyl)ethanol
CID 164684988
(3-methylphenyl)-(2-methyl-4-pyridinyl)methanol
CID 106756084
(2S,3S)-3-(1H-indol-3-yl)butan-2-ol
CID 130705083
(1R,2R)-2-(1H-indol-3-yl)-1,2-diphenylethanol
CID 15981834
(4-fluoro-2-methylphenyl)-(2-methyl-4-pyridinyl)methanol
CID 106756177
1H-indol-3-yl-(4-nitrophenyl)methanol
CID 10265008
3-propan-2-yl-1H-indole
CID 12534824
(2-methyl-4-pyridinyl)-(6-methyl-3-pyridinyl)methanol
CID 106756194
(2-methyl-4-pyridinyl)-(5-methylthiophen-3-yl)methanol
CID 106756231
N-[(2S)-2-(1H-indol-3-yl)-2-phenylethyl]-2-methylpyrimidine-4-carboxamide
CID 52536064
1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine
CID 112742650
isoquinolin-4-yl-(2-methyl-4-pyridinyl)methanamine
CID 106755324

Frequently Asked Questions

What is the IUPAC name of 1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol?
The IUPAC name of 1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol (CID 112742788) is 1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol.
What is the SMILES notation for 1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol?
The canonical SMILES for 1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol is Cc1cc(C(O)c2c[nH]c3ccccc23)ccn1.
What is the InChIKey of 1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol?
The InChIKey is YKBIHTLUORJTAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-10-8-11(6-7-16-10)15(18)13-9-17-14-5-3-2-4-12(13)14/h2-9,15,17-18H,1H3.
What are the key properties of 1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol?
1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol has a molecular weight of 238.29 g/mol, XLogP of 2.95, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol is sourced from PubChem (CID 112742788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).