2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine

C14H16ClN3O2 — CID 103291754

IUPAC2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine
SMILESCOc1ccc(N)c(NCc2c(Cl)cccc2OC)n1
InChIInChI=1S/C14H16ClN3O2/c1-19-12-5-3-4-10(15)9(12)8-17-14-11(16)6-7-13(18-14)20-2/h3-7H,8,16H2,1-2H3,(H,17,18)
InChIKeyGXOXAJADDDTJEL-UHFFFAOYSA-N
MW293.75 g/mol
LogP2.95
Rot. Bonds5

About 2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine

2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine (PubChem CID 103291754) has the molecular formula C14H16ClN3O2 and a molecular weight of 293.75 g/mol. Its IUPAC name is 2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine
PubChem CID103291754
Molecular FormulaC14H16ClN3O2
Molecular Weight293.75 g/mol
Exact Mass293.09
IUPAC Name2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine
SMILESCOc1ccc(N)c(NCc2c(Cl)cccc2OC)n1
InChIInChI=1S/C14H16ClN3O2/c1-19-12-5-3-4-10(15)9(12)8-17-14-11(16)6-7-13(18-14)20-2/h3-7H,8,16H2,1-2H3,(H,17,18)
InChIKeyGXOXAJADDDTJEL-UHFFFAOYSA-N
XLogP2.95
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.75
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine 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

4-N-[(2-chloro-6-methoxyphenyl)methyl]-5-methylpyrimidine-2,4-diamine
CID 103293639
2-N-[(2-chloro-6-methoxyphenyl)methyl]-4-methoxybenzene-1,2-diamine
CID 103291752
N-[(2-chloro-6-methoxyphenyl)methyl]-3-methylpyrazin-2-amine
CID 103292832
6-N-[(2-chloro-6-methoxyphenyl)methyl]-2-N-methylpyridine-2,6-diamine
CID 103293605
N-[(2-chloro-6-methoxyphenyl)methyl]-3-methylpyridin-2-amine
CID 104624373
N-[(2-chloro-6-methoxyphenyl)methyl]-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 103293681
6-methoxy-2-N-[(4-methoxyphenyl)methyl]pyridine-2,3-diamine
CID 115320291
2-N-(2,3-dichlorophenyl)-6-methoxypyridine-2,3-diamine
CID 115320367
6-methoxy-2-N-[(4-methylphenyl)methyl]pyridine-2,3-diamine
CID 113286378
5-N-[(2-chloro-6-methoxyphenyl)methyl]-1,2-thiazole-3,5-diamine
CID 103366048
N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxy-5-methylpyrimidin-4-amine
CID 103292944
1-N-[(2-chloro-6-methoxyphenyl)methyl]-4-fluoro-5-methoxybenzene-1,2-diamine
CID 103291747

Frequently Asked Questions

What is the IUPAC name of 2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine?
The IUPAC name of 2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine (CID 103291754) is 2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine.
What is the SMILES notation for 2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine?
The canonical SMILES for 2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine is COc1ccc(N)c(NCc2c(Cl)cccc2OC)n1.
What is the InChIKey of 2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine?
The InChIKey is GXOXAJADDDTJEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClN3O2/c1-19-12-5-3-4-10(15)9(12)8-17-14-11(16)6-7-13(18-14)20-2/h3-7H,8,16H2,1-2H3,(H,17,18).
What are the key properties of 2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine?
2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine has a molecular weight of 293.75 g/mol, XLogP of 2.95, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[(2-chloro-6-methoxyphenyl)methyl]-6-methoxypyridine-2,3-diamine is sourced from PubChem (CID 103291754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).