6-chloro-2-cyclohexylpyrimidin-4-amine

C10H14ClN3 — CID 82463215

IUPAC6-chloro-2-cyclohexylpyrimidin-4-amine
SMILESNc1cc(Cl)nc(C2CCCCC2)n1
InChIInChI=1S/C10H14ClN3/c11-8-6-9(12)14-10(13-8)7-4-2-1-3-5-7/h6-7H,1-5H2,(H2,12,13,14)
InChIKeyXODGMZBZBDVJGX-UHFFFAOYSA-N
MW211.70 g/mol
LogP2.76
Rot. Bonds1

About 6-chloro-2-cyclohexylpyrimidin-4-amine

6-chloro-2-cyclohexylpyrimidin-4-amine (PubChem CID 82463215) has the molecular formula C10H14ClN3 and a molecular weight of 211.70 g/mol. Its IUPAC name is 6-chloro-2-cyclohexylpyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-2-cyclohexylpyrimidin-4-amine
PubChem CID82463215
Molecular FormulaC10H14ClN3
Molecular Weight211.70 g/mol
Exact Mass211.09
IUPAC Name6-chloro-2-cyclohexylpyrimidin-4-amine
SMILESNc1cc(Cl)nc(C2CCCCC2)n1
InChIInChI=1S/C10H14ClN3/c11-8-6-9(12)14-10(13-8)7-4-2-1-3-5-7/h6-7H,1-5H2,(H2,12,13,14)
InChIKeyXODGMZBZBDVJGX-UHFFFAOYSA-N
XLogP2.76
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.70
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-cyclohexylpyrimidin-4-amine?
The IUPAC name of 6-chloro-2-cyclohexylpyrimidin-4-amine (CID 82463215) is 6-chloro-2-cyclohexylpyrimidin-4-amine.
What is the SMILES notation for 6-chloro-2-cyclohexylpyrimidin-4-amine?
The canonical SMILES for 6-chloro-2-cyclohexylpyrimidin-4-amine is Nc1cc(Cl)nc(C2CCCCC2)n1.
What is the InChIKey of 6-chloro-2-cyclohexylpyrimidin-4-amine?
The InChIKey is XODGMZBZBDVJGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3/c11-8-6-9(12)14-10(13-8)7-4-2-1-3-5-7/h6-7H,1-5H2,(H2,12,13,14).
What are the key properties of 6-chloro-2-cyclohexylpyrimidin-4-amine?
6-chloro-2-cyclohexylpyrimidin-4-amine has a molecular weight of 211.70 g/mol, XLogP of 2.76, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-cyclohexylpyrimidin-4-amine is sourced from PubChem (CID 82463215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).