6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol

C17H16N2O — CID 136996645

IUPAC6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol
SMILESCc1ccc2c(/C=N/c3ccccc3C)c(O)[nH]c2c1
InChIInChI=1S/C17H16N2O/c1-11-7-8-13-14(17(20)19-16(13)9-11)10-18-15-6-4-3-5-12(15)2/h3-10,19-20H,1-2H3/b18-10+
InChIKeyOSRQIPSRYJHGLW-VCHYOVAHSA-N
MW264.33 g/mol
LogP4.24
Rot. Bonds2

About 6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol

6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol (PubChem CID 136996645) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol.

Molecular Properties

Compound Name6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol
PubChem CID136996645
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol
SMILESCc1ccc2c(/C=N/c3ccccc3C)c(O)[nH]c2c1
InChIInChI=1S/C17H16N2O/c1-11-7-8-13-14(17(20)19-16(13)9-11)10-18-15-6-4-3-5-12(15)2/h3-10,19-20H,1-2H3/b18-10+
InChIKeyOSRQIPSRYJHGLW-VCHYOVAHSA-N
XLogP4.24
TPSA48.38 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

3-[(2-bromo-4-methylphenyl)iminomethyl]-6-methyl-1H-indol-2-ol
CID 137006199
6-chloro-3-[(2,5-dimethylphenyl)iminomethyl]-1H-indol-2-ol
CID 137006420
3-[(3-chloro-4-fluorophenyl)iminomethyl]-6-methyl-1H-indol-2-ol
CID 137006158
6-chloro-3-[(3-chloro-2-methylphenyl)iminomethyl]-1H-indol-2-ol
CID 137006440
3-[2-(2-fluorophenyl)ethyliminomethyl]-6-methyl-1H-indol-2-ol
CID 136996625
6-methyl-3-[(4-methylphenyl)methyliminomethyl]-1H-indol-2-ol
CID 136996612
6-methyl-3-[(4-piperidin-1-ylphenyl)iminomethyl]-1H-indol-2-ol
CID 137006190
4-methyl-2-[(2-methylphenyl)iminomethyl]phenol
CID 136675822
3-[(2-chloro-4,6-dimethylphenyl)iminomethyl]-1H-indol-2-ol
CID 136995976
3-[(3-methoxyphenyl)iminomethyl]-5-methyl-1H-indol-2-ol
CID 136996527
6-(furan-2-yl)-3-[(2-methoxyphenyl)iminomethyl]-1H-indol-2-ol
CID 135581614
5-methoxy-3-[(2-methoxy-5-methylphenyl)iminomethyl]-1H-indol-2-ol
CID 136996378

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol?
The IUPAC name of 6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol (CID 136996645) is 6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol.
What is the SMILES notation for 6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol?
The canonical SMILES for 6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol is Cc1ccc2c(/C=N/c3ccccc3C)c(O)[nH]c2c1.
What is the InChIKey of 6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol?
The InChIKey is OSRQIPSRYJHGLW-VCHYOVAHSA-N. The full InChI is InChI=1S/C17H16N2O/c1-11-7-8-13-14(17(20)19-16(13)9-11)10-18-15-6-4-3-5-12(15)2/h3-10,19-20H,1-2H3/b18-10+.
What are the key properties of 6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol?
6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol has a molecular weight of 264.33 g/mol, XLogP of 4.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-[(2-methylphenyl)iminomethyl]-1H-indol-2-ol is sourced from PubChem (CID 136996645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).