2-chloro-N,N,6-trimethylpyrimidin-4-amine

C7H10ClN3 — CID 10813

IUPAC2-chloro-N,N,6-trimethylpyrimidin-4-amine
SMILESCc1cc(N(C)C)nc(Cl)n1
InChIInChI=1S/C7H10ClN3/c1-5-4-6(11(2)3)10-7(8)9-5/h4H,1-3H3
InChIKeyHJIUPFPIEBPYIE-UHFFFAOYSA-N
MW171.63 g/mol
LogP1.50
Rot. Bonds1

About 2-chloro-N,N,6-trimethylpyrimidin-4-amine

2-chloro-N,N,6-trimethylpyrimidin-4-amine (PubChem CID 10813) has the molecular formula C7H10ClN3 and a molecular weight of 171.63 g/mol. Its IUPAC name is 2-chloro-N,N,6-trimethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-chloro-N,N,6-trimethylpyrimidin-4-amine
PubChem CID10813
Molecular FormulaC7H10ClN3
Molecular Weight171.63 g/mol
Exact Mass171.06
IUPAC Name2-chloro-N,N,6-trimethylpyrimidin-4-amine
SMILESCc1cc(N(C)C)nc(Cl)n1
InChIInChI=1S/C7H10ClN3/c1-5-4-6(11(2)3)10-7(8)9-5/h4H,1-3H3
InChIKeyHJIUPFPIEBPYIE-UHFFFAOYSA-N
XLogP1.50
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.63
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N,N,6-trimethylpyrimidin-4-amine?
The IUPAC name of 2-chloro-N,N,6-trimethylpyrimidin-4-amine (CID 10813) is 2-chloro-N,N,6-trimethylpyrimidin-4-amine.
What is the SMILES notation for 2-chloro-N,N,6-trimethylpyrimidin-4-amine?
The canonical SMILES for 2-chloro-N,N,6-trimethylpyrimidin-4-amine is Cc1cc(N(C)C)nc(Cl)n1.
What is the InChIKey of 2-chloro-N,N,6-trimethylpyrimidin-4-amine?
The InChIKey is HJIUPFPIEBPYIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3/c1-5-4-6(11(2)3)10-7(8)9-5/h4H,1-3H3.
What are the key properties of 2-chloro-N,N,6-trimethylpyrimidin-4-amine?
2-chloro-N,N,6-trimethylpyrimidin-4-amine has a molecular weight of 171.63 g/mol, XLogP of 1.50, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N,N,6-trimethylpyrimidin-4-amine is sourced from PubChem (CID 10813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).