2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine

C15H24N6 — CID 66132148

IUPAC2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine
SMILESCCCn1cncc1-c1nc(C2CCCCC2)n(N)c1N
InChIInChI=1S/C15H24N6/c1-2-8-20-10-18-9-12(20)13-14(16)21(17)15(19-13)11-6-4-3-5-7-11/h9-11H,2-8,16-17H2,1H3
InChIKeyYMTBTXSQYGFRJS-UHFFFAOYSA-N
MW288.40 g/mol
LogP2.50
Rot. Bonds4

About 2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine

2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine (PubChem CID 66132148) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is 2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine.

Molecular Properties

Compound Name2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine
PubChem CID66132148
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC Name2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine
SMILESCCCn1cncc1-c1nc(C2CCCCC2)n(N)c1N
InChIInChI=1S/C15H24N6/c1-2-8-20-10-18-9-12(20)13-14(16)21(17)15(19-13)11-6-4-3-5-7-11/h9-11H,2-8,16-17H2,1H3
InChIKeyYMTBTXSQYGFRJS-UHFFFAOYSA-N
XLogP2.50
TPSA87.68 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine?
The IUPAC name of 2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine (CID 66132148) is 2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine.
What is the SMILES notation for 2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine?
The canonical SMILES for 2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine is CCCn1cncc1-c1nc(C2CCCCC2)n(N)c1N.
What is the InChIKey of 2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine?
The InChIKey is YMTBTXSQYGFRJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-2-8-20-10-18-9-12(20)13-14(16)21(17)15(19-13)11-6-4-3-5-7-11/h9-11H,2-8,16-17H2,1H3.
What are the key properties of 2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine?
2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine has a molecular weight of 288.40 g/mol, XLogP of 2.50, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine is sourced from PubChem (CID 66132148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).