1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol

C17H14N2O — CID 809927

IUPAC1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol
SMILESCc1ccnc(/N=C/c2c(O)ccc3ccccc23)c1
InChIInChI=1S/C17H14N2O/c1-12-8-9-18-17(10-12)19-11-15-14-5-3-2-4-13(14)6-7-16(15)20/h2-11,20H,1H3/b19-11+
InChIKeyJXLZYMPHURMGGE-YBFXNURJSA-N
MW262.31 g/mol
LogP4.00
Rot. Bonds2

About 1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol

1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol (PubChem CID 809927) has the molecular formula C17H14N2O and a molecular weight of 262.31 g/mol. Its IUPAC name is 1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol
PubChem CID809927
Molecular FormulaC17H14N2O
Molecular Weight262.31 g/mol
Exact Mass262.11
IUPAC Name1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol
SMILESCc1ccnc(/N=C/c2c(O)ccc3ccccc23)c1
InChIInChI=1S/C17H14N2O/c1-12-8-9-18-17(10-12)19-11-15-14-5-3-2-4-13(14)6-7-16(15)20/h2-11,20H,1H3/b19-11+
InChIKeyJXLZYMPHURMGGE-YBFXNURJSA-N
XLogP4.00
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(2,4,6-trimethylphenyl)iminomethyl]naphthalen-2-ol
CID 1284713
1-[(3,5-dimethylphenyl)iminomethyl]naphthalen-2-ol
CID 794532
1-[(E)-(3-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol
CID 135459002
copper;bis(2-[(4-methyl-2-pyridinyl)iminomethyl]phenol)
CID 137200643
1-[(E)-2-[(4-methyl-2-pyridinyl)amino]ethenyl]naphthalen-2-ol
CID 21239600
1-[(E)-1,3-thiazol-2-yliminomethyl]naphthalen-2-ol
CID 135443142
4-bromo-2-[(4-methyl-2-pyridinyl)iminomethyl]phenol
CID 869448
1-[(E)-hydroxyiminomethyl]naphthalen-2-ol
CID 135400485
1-[(4,5-dimethoxy-2-methylphenyl)iminomethyl]naphthalen-2-ol
CID 135595898
1-[(3,5-dichloro-4-hydroxyphenyl)iminomethyl]naphthalen-2-ol
CID 630306
1-[(5-bromo-2-hydroxyphenyl)iminomethyl]naphthalen-2-ol
CID 794050
1-(2H-tetrazol-5-yliminomethyl)naphthalen-2-ol
CID 136695197

Frequently Asked Questions

What is the IUPAC name of 1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol?
The IUPAC name of 1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol (CID 809927) is 1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol.
What is the SMILES notation for 1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol?
The canonical SMILES for 1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol is Cc1ccnc(/N=C/c2c(O)ccc3ccccc23)c1.
What is the InChIKey of 1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol?
The InChIKey is JXLZYMPHURMGGE-YBFXNURJSA-N. The full InChI is InChI=1S/C17H14N2O/c1-12-8-9-18-17(10-12)19-11-15-14-5-3-2-4-13(14)6-7-16(15)20/h2-11,20H,1H3/b19-11+.
What are the key properties of 1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol?
1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol has a molecular weight of 262.31 g/mol, XLogP of 4.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methyl-2-pyridinyl)iminomethyl]naphthalen-2-ol is sourced from PubChem (CID 809927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).