4-chloro-5-methylpyrimidin-2-amine

C5H6ClN3 — CID 588628

IUPAC4-chloro-5-methylpyrimidin-2-amine
SMILESCc1cnc(N)nc1Cl
InChIInChI=1S/C5H6ClN3/c1-3-2-8-5(7)9-4(3)6/h2H,1H3,(H2,7,8,9)
InChIKeyUDBZUFZWXJJBAL-UHFFFAOYSA-N
MW143.58 g/mol
LogP1.02
Rot. Bonds

About 4-chloro-5-methylpyrimidin-2-amine

4-chloro-5-methylpyrimidin-2-amine (PubChem CID 588628) has the molecular formula C5H6ClN3 and a molecular weight of 143.58 g/mol. Its IUPAC name is 4-chloro-5-methylpyrimidin-2-amine.

Molecular Properties

Compound Name4-chloro-5-methylpyrimidin-2-amine
PubChem CID588628
Molecular FormulaC5H6ClN3
Molecular Weight143.58 g/mol
Exact Mass143.03
IUPAC Name4-chloro-5-methylpyrimidin-2-amine
SMILESCc1cnc(N)nc1Cl
InChIInChI=1S/C5H6ClN3/c1-3-2-8-5(7)9-4(3)6/h2H,1H3,(H2,7,8,9)
InChIKeyUDBZUFZWXJJBAL-UHFFFAOYSA-N
XLogP1.02
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.58
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Amino-2-methyl-5-pyrimidinemethanamine
CID 66762
2,5-Dimethylpyrimidin-4-Amine
CID 445779
2,4,5-Trichloropyrimidine
CID 237259
2-Pyrimidinamine, 5-chloro-
CID 79479
2-Chloro-5-(trifluoromethyl)pyrimidine
CID 13317019
5-Chloro-2-methoxypyrimidine
CID 142258
5-Chloropyrimidine
CID 12600384
Pyrimidine, 2,4-dichloro-5-methyl-
CID 74508
5-Methylpyrimidine
CID 74859
2,4-Dichloro-5-(beta-chloroethyl)pyrimidine
CID 56835046
2,4-Dichloro-5-iodopyrimidine
CID 263438
5-Methylpyrimidin-4-amine
CID 21719209

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-methylpyrimidin-2-amine?
The IUPAC name of 4-chloro-5-methylpyrimidin-2-amine (CID 588628) is 4-chloro-5-methylpyrimidin-2-amine.
What is the SMILES notation for 4-chloro-5-methylpyrimidin-2-amine?
The canonical SMILES for 4-chloro-5-methylpyrimidin-2-amine is Cc1cnc(N)nc1Cl.
What is the InChIKey of 4-chloro-5-methylpyrimidin-2-amine?
The InChIKey is UDBZUFZWXJJBAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6ClN3/c1-3-2-8-5(7)9-4(3)6/h2H,1H3,(H2,7,8,9).
What are the key properties of 4-chloro-5-methylpyrimidin-2-amine?
4-chloro-5-methylpyrimidin-2-amine has a molecular weight of 143.58 g/mol, XLogP of 1.02, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-methylpyrimidin-2-amine is sourced from PubChem (CID 588628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).