4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine

C9H15N3O — CID 61360000

IUPAC4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine
SMILESCOCCN(C)c1ccncc1N
InChIInChI=1S/C9H15N3O/c1-12(5-6-13-2)9-3-4-11-7-8(9)10/h3-4,7H,5-6,10H2,1-2H3
InChIKeyWDKOUGACYPBZTQ-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.75
Rot. Bonds4

About 4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine

4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine (PubChem CID 61360000) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine.

Molecular Properties

Compound Name4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine
PubChem CID61360000
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine
SMILESCOCCN(C)c1ccncc1N
InChIInChI=1S/C9H15N3O/c1-12(5-6-13-2)9-3-4-11-7-8(9)10/h3-4,7H,5-6,10H2,1-2H3
InChIKeyWDKOUGACYPBZTQ-UHFFFAOYSA-N
XLogP0.75
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-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-methyl-4-N-[2-(3-methylbutoxy)ethyl]pyridine-3,4-diamine
CID 54956565
4-N-(2-methoxyethyl)-4-N-pentan-3-ylpyridine-3,4-diamine
CID 55004103
4-N-[2-(diethylamino)ethyl]-4-N-methylpyridine-3,4-diamine
CID 61359414
4-N-(1-methoxypropan-2-yl)-4-N-methylpyridine-3,4-diamine
CID 61450034
4-[(3-amino-4-pyridinyl)-methylamino]-2-methylbutan-2-ol
CID 79356009
4-N-methyl-4-N-(2-phenylsulfanylethyl)pyridine-3,4-diamine
CID 79222292
4-[(3-amino-4-pyridinyl)-methylamino]butanenitrile
CID 61358059
4-N-methyl-4-N-(2-pyridin-3-ylethyl)pyridine-3,4-diamine
CID 63262874
4-N-methyl-4-N-[2-(trifluoromethylsulfanyl)ethyl]pyridine-3,4-diamine
CID 116616296
4-N,4-N-dimethylpyridine-3,4-diamine
CID 14088946
2-[(3-amino-4-pyridinyl)-methylamino]acetic acid
CID 62253485
4-N-methyl-4-N-(pyrimidin-2-ylmethyl)pyridine-3,4-diamine
CID 62698618

Frequently Asked Questions

What is the IUPAC name of 4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine?
The IUPAC name of 4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine (CID 61360000) is 4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine.
What is the SMILES notation for 4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine?
The canonical SMILES for 4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine is COCCN(C)c1ccncc1N.
What is the InChIKey of 4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine?
The InChIKey is WDKOUGACYPBZTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-12(5-6-13-2)9-3-4-11-7-8(9)10/h3-4,7H,5-6,10H2,1-2H3.
What are the key properties of 4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine?
4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine has a molecular weight of 181.24 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine is sourced from PubChem (CID 61360000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).