2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol

C15H16N2O — CID 116985992

IUPAC2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol
SMILESCn1c2ccncc2c2cc(C(C)(C)O)ccc21
InChIInChI=1S/C15H16N2O/c1-15(2,18)10-4-5-13-11(8-10)12-9-16-7-6-14(12)17(13)3/h4-9,18H,1-3H3
InChIKeyWYIAKSTWABGHKH-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.95
Rot. Bonds1

About 2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol

2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol (PubChem CID 116985992) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol.

Molecular Properties

Compound Name2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol
PubChem CID116985992
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol
SMILESCn1c2ccncc2c2cc(C(C)(C)O)ccc21
InChIInChI=1S/C15H16N2O/c1-15(2,18)10-4-5-13-11(8-10)12-9-16-7-6-14(12)17(13)3/h4-9,18H,1-3H3
InChIKeyWYIAKSTWABGHKH-UHFFFAOYSA-N
XLogP2.95
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-methylpyrido[4,3-b]indol-8-yl)hydrazine
CID 116986023
2-methyl-2-(5-methylpyrido[4,3-b]indol-7-yl)propanenitrile
CID 116986204
2-(5-methylpyrido[4,3-b]indol-8-yl)acetic acid
CID 116985962
2-isoquinolin-6-ylpropan-2-ol
CID 117280841
(5-methylpyrido[4,3-b]indol-7-yl)methanol
CID 116986177
4-(5-methylpyrido[4,3-b]indol-8-yl)butan-2-one
CID 116985988
3-(5-methylpyrido[4,3-b]indol-8-yl)cyclobutan-1-amine
CID 116985955
methyl 5-methylpyrido[4,3-b]indole-7-carboxylate
CID 116986202
6-(2,2-dimethylpropyl)-9-methylpyrido[3,4-b]indole
CID 67988444
5-methyl-7-phenylpyrido[4,3-b]indole
CID 155583386
1-(5-methylpyrido[4,3-b]indol-8-yl)cyclopropane-1-carbonitrile
CID 116985998
3,6-ditert-butyl-9-[4-[3-(3,6-ditert-butylcarbazol-9-yl)-4-pyridinyl]-3-pyridinyl]carbazole
CID 122433677

Frequently Asked Questions

What is the IUPAC name of 2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol?
The IUPAC name of 2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol (CID 116985992) is 2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol.
What is the SMILES notation for 2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol?
The canonical SMILES for 2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol is Cn1c2ccncc2c2cc(C(C)(C)O)ccc21.
What is the InChIKey of 2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol?
The InChIKey is WYIAKSTWABGHKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-15(2,18)10-4-5-13-11(8-10)12-9-16-7-6-14(12)17(13)3/h4-9,18H,1-3H3.
What are the key properties of 2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol?
2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol has a molecular weight of 240.31 g/mol, XLogP of 2.95, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylpyrido[4,3-b]indol-8-yl)propan-2-ol is sourced from PubChem (CID 116985992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).