cyclohexanamine;ethane;pyrimidin-4-amine

C12H24N4 — CID 144655058

IUPACcyclohexanamine;ethane;pyrimidin-4-amine
SMILESCC.NC1CCCCC1.Nc1ccncn1
InChIInChI=1S/C6H13N.C4H5N3.C2H6/c7-6-4-2-1-3-5-6;5-4-1-2-6-3-7-4;1-2/h6H,1-5,7H2;1-3H,(H2,5,6,7);1-2H3
InChIKeyLPGMXGFXIILSRA-UHFFFAOYSA-N
MW224.35 g/mol
LogP2.36
Rot. Bonds

About cyclohexanamine;ethane;pyrimidin-4-amine

cyclohexanamine;ethane;pyrimidin-4-amine (PubChem CID 144655058) has the molecular formula C12H24N4 and a molecular weight of 224.35 g/mol. Its IUPAC name is cyclohexanamine;ethane;pyrimidin-4-amine.

Molecular Properties

Compound Namecyclohexanamine;ethane;pyrimidin-4-amine
PubChem CID144655058
Molecular FormulaC12H24N4
Molecular Weight224.35 g/mol
Exact Mass224.20
IUPAC Namecyclohexanamine;ethane;pyrimidin-4-amine
SMILESCC.NC1CCCCC1.Nc1ccncn1
InChIInChI=1S/C6H13N.C4H5N3.C2H6/c7-6-4-2-1-3-5-6;5-4-1-2-6-3-7-4;1-2/h6H,1-5,7H2;1-3H,(H2,5,6,7);1-2H3
InChIKeyLPGMXGFXIILSRA-UHFFFAOYSA-N
XLogP2.36
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of cyclohexanamine;ethane;pyrimidin-4-amine?
The IUPAC name of cyclohexanamine;ethane;pyrimidin-4-amine (CID 144655058) is cyclohexanamine;ethane;pyrimidin-4-amine.
What is the SMILES notation for cyclohexanamine;ethane;pyrimidin-4-amine?
The canonical SMILES for cyclohexanamine;ethane;pyrimidin-4-amine is CC.NC1CCCCC1.Nc1ccncn1.
What is the InChIKey of cyclohexanamine;ethane;pyrimidin-4-amine?
The InChIKey is LPGMXGFXIILSRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N.C4H5N3.C2H6/c7-6-4-2-1-3-5-6;5-4-1-2-6-3-7-4;1-2/h6H,1-5,7H2;1-3H,(H2,5,6,7);1-2H3.
What are the key properties of cyclohexanamine;ethane;pyrimidin-4-amine?
cyclohexanamine;ethane;pyrimidin-4-amine has a molecular weight of 224.35 g/mol, XLogP of 2.36, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexanamine;ethane;pyrimidin-4-amine is sourced from PubChem (CID 144655058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).