5-cyclohexylpyrimidin-2-amine

C10H15N3 — CID 13163993

IUPAC5-cyclohexylpyrimidin-2-amine
SMILESNc1ncc(C2CCCCC2)cn1
InChIInChI=1S/C10H15N3/c11-10-12-6-9(7-13-10)8-4-2-1-3-5-8/h6-8H,1-5H2,(H2,11,12,13)
InChIKeyOXBJITNIEIJQGP-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.11
Rot. Bonds1

About 5-cyclohexylpyrimidin-2-amine

5-cyclohexylpyrimidin-2-amine (PubChem CID 13163993) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 5-cyclohexylpyrimidin-2-amine.

Molecular Properties

Compound Name5-cyclohexylpyrimidin-2-amine
PubChem CID13163993
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name5-cyclohexylpyrimidin-2-amine
SMILESNc1ncc(C2CCCCC2)cn1
InChIInChI=1S/C10H15N3/c11-10-12-6-9(7-13-10)8-4-2-1-3-5-8/h6-8H,1-5H2,(H2,11,12,13)
InChIKeyOXBJITNIEIJQGP-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 5-cyclohexylpyrimidin-2-amine?
The IUPAC name of 5-cyclohexylpyrimidin-2-amine (CID 13163993) is 5-cyclohexylpyrimidin-2-amine.
What is the SMILES notation for 5-cyclohexylpyrimidin-2-amine?
The canonical SMILES for 5-cyclohexylpyrimidin-2-amine is Nc1ncc(C2CCCCC2)cn1.
What is the InChIKey of 5-cyclohexylpyrimidin-2-amine?
The InChIKey is OXBJITNIEIJQGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c11-10-12-6-9(7-13-10)8-4-2-1-3-5-8/h6-8H,1-5H2,(H2,11,12,13).
What are the key properties of 5-cyclohexylpyrimidin-2-amine?
5-cyclohexylpyrimidin-2-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 5-cyclohexylpyrimidin-2-amine is sourced from PubChem (CID 13163993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).