2-cyclohexylpyrimidin-5-amine

C10H15N3 — CID 43142237

IUPAC2-cyclohexylpyrimidin-5-amine
SMILESNc1cnc(C2CCCCC2)nc1
InChIInChI=1S/C10H15N3/c11-9-6-12-10(13-7-9)8-4-2-1-3-5-8/h6-8H,1-5,11H2
InChIKeyHMKOLGXUHOKSNG-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.11
Rot. Bonds1

About 2-cyclohexylpyrimidin-5-amine

2-cyclohexylpyrimidin-5-amine (PubChem CID 43142237) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-cyclohexylpyrimidin-5-amine.

Molecular Properties

Compound Name2-cyclohexylpyrimidin-5-amine
PubChem CID43142237
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name2-cyclohexylpyrimidin-5-amine
SMILESNc1cnc(C2CCCCC2)nc1
InChIInChI=1S/C10H15N3/c11-9-6-12-10(13-7-9)8-4-2-1-3-5-8/h6-8H,1-5,11H2
InChIKeyHMKOLGXUHOKSNG-UHFFFAOYSA-N
XLogP2.11
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylpyrimidin-5-amine?
The IUPAC name of 2-cyclohexylpyrimidin-5-amine (CID 43142237) is 2-cyclohexylpyrimidin-5-amine.
What is the SMILES notation for 2-cyclohexylpyrimidin-5-amine?
The canonical SMILES for 2-cyclohexylpyrimidin-5-amine is Nc1cnc(C2CCCCC2)nc1.
What is the InChIKey of 2-cyclohexylpyrimidin-5-amine?
The InChIKey is HMKOLGXUHOKSNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c11-9-6-12-10(13-7-9)8-4-2-1-3-5-8/h6-8H,1-5,11H2.
What are the key properties of 2-cyclohexylpyrimidin-5-amine?
2-cyclohexylpyrimidin-5-amine has a molecular weight of 177.25 g/mol, XLogP of 2.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylpyrimidin-5-amine is sourced from PubChem (CID 43142237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).