N-cyclohexylpyrimidin-2-amine

C10H15N3 — CID 21252719

IUPACN-cyclohexylpyrimidin-2-amine
SMILESc1cnc(NC2CCCCC2)nc1
InChIInChI=1S/C10H15N3/c1-2-5-9(6-3-1)13-10-11-7-4-8-12-10/h4,7-9H,1-3,5-6H2,(H,11,12,13)
InChIKeyKJCZIGIPLGGJRT-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.22
Rot. Bonds2

About N-cyclohexylpyrimidin-2-amine

N-cyclohexylpyrimidin-2-amine (PubChem CID 21252719) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is N-cyclohexylpyrimidin-2-amine.

Molecular Properties

Compound NameN-cyclohexylpyrimidin-2-amine
PubChem CID21252719
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC NameN-cyclohexylpyrimidin-2-amine
SMILESc1cnc(NC2CCCCC2)nc1
InChIInChI=1S/C10H15N3/c1-2-5-9(6-3-1)13-10-11-7-4-8-12-10/h4,7-9H,1-3,5-6H2,(H,11,12,13)
InChIKeyKJCZIGIPLGGJRT-UHFFFAOYSA-N
XLogP2.22
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexylpyrimidin-2-amine?
The IUPAC name of N-cyclohexylpyrimidin-2-amine (CID 21252719) is N-cyclohexylpyrimidin-2-amine.
What is the SMILES notation for N-cyclohexylpyrimidin-2-amine?
The canonical SMILES for N-cyclohexylpyrimidin-2-amine is c1cnc(NC2CCCCC2)nc1.
What is the InChIKey of N-cyclohexylpyrimidin-2-amine?
The InChIKey is KJCZIGIPLGGJRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-2-5-9(6-3-1)13-10-11-7-4-8-12-10/h4,7-9H,1-3,5-6H2,(H,11,12,13).
What are the key properties of N-cyclohexylpyrimidin-2-amine?
N-cyclohexylpyrimidin-2-amine has a molecular weight of 177.25 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylpyrimidin-2-amine is sourced from PubChem (CID 21252719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).