(5-methylpyrido[4,3-b]indol-7-yl)methanol

C13H12N2O — CID 116986177

IUPAC(5-methylpyrido[4,3-b]indol-7-yl)methanol
SMILESCn1c2ccncc2c2ccc(CO)cc21
InChIInChI=1S/C13H12N2O/c1-15-12-4-5-14-7-11(12)10-3-2-9(8-16)6-13(10)15/h2-7,16H,8H2,1H3
InChIKeyBLXBPIJDOBKJEZ-UHFFFAOYSA-N
MW212.25 g/mol
LogP2.22
Rot. Bonds1

About (5-methylpyrido[4,3-b]indol-7-yl)methanol

(5-methylpyrido[4,3-b]indol-7-yl)methanol (PubChem CID 116986177) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is (5-methylpyrido[4,3-b]indol-7-yl)methanol.

Molecular Properties

Compound Name(5-methylpyrido[4,3-b]indol-7-yl)methanol
PubChem CID116986177
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC Name(5-methylpyrido[4,3-b]indol-7-yl)methanol
SMILESCn1c2ccncc2c2ccc(CO)cc21
InChIInChI=1S/C13H12N2O/c1-15-12-4-5-14-7-11(12)10-3-2-9(8-16)6-13(10)15/h2-7,16H,8H2,1H3
InChIKeyBLXBPIJDOBKJEZ-UHFFFAOYSA-N
XLogP2.22
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-methylpyrido[4,3-b]indol-7-yl)methyl]cyclopropanamine
CID 116986165
N-ethyl-3-(5-methylpyrido[4,3-b]indol-7-yl)propanamide;molecular hydrogen
CID 142517138
3-(5-methylpyrido[4,3-b]indol-7-yl)-N-prop-1-en-2-ylpropanamide
CID 137418675
2-(5-methylpyrido[4,3-b]indol-8-yl)acetic acid
CID 116985962
5-methyl-7-phenylpyrido[4,3-b]indole
CID 155583386
methyl 5-methylpyrido[4,3-b]indole-7-carboxylate
CID 116986202
4-(5-methylpyrido[4,3-b]indol-8-yl)butan-2-one
CID 116985988
2-methyl-2-(5-methylpyrido[4,3-b]indol-7-yl)propanenitrile
CID 116986204
2-(5-methylpyrido[4,3-b]indol-7-yl)cyclopropane-1-carboxylic acid
CID 116986188
2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol
CID 116985992
6-(2,2-dimethylpropyl)-9-methylpyrido[3,4-b]indole
CID 67988444
(5-methylpyrido[4,3-b]indol-8-yl)hydrazine
CID 116986023

Frequently Asked Questions

What is the IUPAC name of (5-methylpyrido[4,3-b]indol-7-yl)methanol?
The IUPAC name of (5-methylpyrido[4,3-b]indol-7-yl)methanol (CID 116986177) is (5-methylpyrido[4,3-b]indol-7-yl)methanol.
What is the SMILES notation for (5-methylpyrido[4,3-b]indol-7-yl)methanol?
The canonical SMILES for (5-methylpyrido[4,3-b]indol-7-yl)methanol is Cn1c2ccncc2c2ccc(CO)cc21.
What is the InChIKey of (5-methylpyrido[4,3-b]indol-7-yl)methanol?
The InChIKey is BLXBPIJDOBKJEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O/c1-15-12-4-5-14-7-11(12)10-3-2-9(8-16)6-13(10)15/h2-7,16H,8H2,1H3.
What are the key properties of (5-methylpyrido[4,3-b]indol-7-yl)methanol?
(5-methylpyrido[4,3-b]indol-7-yl)methanol has a molecular weight of 212.25 g/mol, XLogP of 2.22, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylpyrido[4,3-b]indol-7-yl)methanol is sourced from PubChem (CID 116986177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).