2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine

C12H21N3O — CID 115921521

IUPAC2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine
SMILESCCC(COC)Nc1ccc(N(C)C)cn1
InChIInChI=1S/C12H21N3O/c1-5-10(9-16-4)14-12-7-6-11(8-13-12)15(2)3/h6-8,10H,5,9H2,1-4H3,(H,13,14)
InChIKeyJDJBFNZFJFFBOU-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.98
Rot. Bonds6

About 2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine

2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine (PubChem CID 115921521) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine
PubChem CID115921521
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine
SMILESCCC(COC)Nc1ccc(N(C)C)cn1
InChIInChI=1S/C12H21N3O/c1-5-10(9-16-4)14-12-7-6-11(8-13-12)15(2)3/h6-8,10H,5,9H2,1-4H3,(H,13,14)
InChIKeyJDJBFNZFJFFBOU-UHFFFAOYSA-N
XLogP1.98
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-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

6-N-(1-methoxybutan-2-yl)-2-N-methylpyridine-2,6-diamine
CID 80836609
5-chloro-2-(1-methoxybutan-2-ylamino)pyridine-4-carboxylic acid
CID 114919705
4-iodo-N-(1-methoxybutan-2-yl)pyridin-2-amine
CID 163875838
5-(1-methoxybutan-2-ylamino)pyridine-2-carbonitrile
CID 115487722
5-bromo-N-(1-chloro-3-methoxypropan-2-yl)pyridin-2-amine
CID 106181473
5-N,5-N-dimethyl-2-N-(2-methylpropyl)pyridine-2,5-diamine
CID 115876832
4-N-(1-methoxybutan-2-yl)-2-N-methylpyrimidine-2,4-diamine
CID 80837219
2-N-pentan-3-ylpyridine-2,5-diamine
CID 16775519
5-bromo-N-pentan-3-ylpyridin-2-amine
CID 28553670
2-N-ethyl-4-N-(1-methoxybutan-2-yl)pyrimidine-2,4-diamine
CID 80837494
2-N-(1-methoxybutan-2-yl)-1,3-thiazole-2,5-diamine
CID 102768548
N,N-dimethyl-6-(pentan-3-ylamino)pyridine-3-carboxamide
CID 78956363

Frequently Asked Questions

What is the IUPAC name of 2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine?
The IUPAC name of 2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine (CID 115921521) is 2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine.
What is the SMILES notation for 2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine?
The canonical SMILES for 2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine is CCC(COC)Nc1ccc(N(C)C)cn1.
What is the InChIKey of 2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine?
The InChIKey is JDJBFNZFJFFBOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-5-10(9-16-4)14-12-7-6-11(8-13-12)15(2)3/h6-8,10H,5,9H2,1-4H3,(H,13,14).
What are the key properties of 2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine?
2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine has a molecular weight of 223.32 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-methoxybutan-2-yl)-5-N,5-N-dimethylpyridine-2,5-diamine is sourced from PubChem (CID 115921521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).