5-chloro-4,6-dimethylpyridine-2,3-diamine

C7H10ClN3 — CID 58772632

IUPAC5-chloro-4,6-dimethylpyridine-2,3-diamine
SMILESCc1nc(N)c(N)c(C)c1Cl
InChIInChI=1S/C7H10ClN3/c1-3-5(8)4(2)11-7(10)6(3)9/h9H2,1-2H3,(H2,10,11)
InChIKeyXYYOQAPQGIDEBN-UHFFFAOYSA-N
MW171.63 g/mol
LogP1.52
Rot. Bonds

About 5-chloro-4,6-dimethylpyridine-2,3-diamine

5-chloro-4,6-dimethylpyridine-2,3-diamine (PubChem CID 58772632) has the molecular formula C7H10ClN3 and a molecular weight of 171.63 g/mol. Its IUPAC name is 5-chloro-4,6-dimethylpyridine-2,3-diamine.

Molecular Properties

Compound Name5-chloro-4,6-dimethylpyridine-2,3-diamine
PubChem CID58772632
Molecular FormulaC7H10ClN3
Molecular Weight171.63 g/mol
Exact Mass171.06
IUPAC Name5-chloro-4,6-dimethylpyridine-2,3-diamine
SMILESCc1nc(N)c(N)c(C)c1Cl
InChIInChI=1S/C7H10ClN3/c1-3-5(8)4(2)11-7(10)6(3)9/h9H2,1-2H3,(H2,10,11)
InChIKeyXYYOQAPQGIDEBN-UHFFFAOYSA-N
XLogP1.52
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.63
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-4,6-dimethylpyridine-2,3-diamine
CID 15827793
5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane
CID 156715440
5,6-diamino-2,4-dimethylpyridine-3-carbonitrile
CID 54463519
6-amino-4,5-dichloro-2-methylpyridin-3-ol
CID 141441539
2,4,6-trichloro-3,5-dimethylaniline
CID 130155317
2,6-dimethylpyrimidine-4,5-diamine
CID 19898795
(4-amino-6-chloro-5-methylpyrimidin-2-yl)methanethiol
CID 122575657
2-chloro-3-fluoro-5,6-dimethylpyridin-4-amine;ethane
CID 177008253
2-amino-5-chloro-4-methyl-1H-pyrimidin-6-one
CID 135905258
2,6-dimethylpyridine-3,4,5-triamine
CID 21436310
3,6-dichloro-2-methylquinolin-4-amine
CID 121236621
3-chloro-2,4,5-trimethyl-6-(trifluoromethoxy)aniline
CID 54008381

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4,6-dimethylpyridine-2,3-diamine?
The IUPAC name of 5-chloro-4,6-dimethylpyridine-2,3-diamine (CID 58772632) is 5-chloro-4,6-dimethylpyridine-2,3-diamine.
What is the SMILES notation for 5-chloro-4,6-dimethylpyridine-2,3-diamine?
The canonical SMILES for 5-chloro-4,6-dimethylpyridine-2,3-diamine is Cc1nc(N)c(N)c(C)c1Cl.
What is the InChIKey of 5-chloro-4,6-dimethylpyridine-2,3-diamine?
The InChIKey is XYYOQAPQGIDEBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3/c1-3-5(8)4(2)11-7(10)6(3)9/h9H2,1-2H3,(H2,10,11).
What are the key properties of 5-chloro-4,6-dimethylpyridine-2,3-diamine?
5-chloro-4,6-dimethylpyridine-2,3-diamine has a molecular weight of 171.63 g/mol, XLogP of 1.52, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4,6-dimethylpyridine-2,3-diamine is sourced from PubChem (CID 58772632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).