2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine

C14H26N4 — CID 114201131

IUPAC2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine
SMILESCC(C)CC(C)c1nc(C2CCCC2)n(N)c1N
InChIInChI=1S/C14H26N4/c1-9(2)8-10(3)12-13(15)18(16)14(17-12)11-6-4-5-7-11/h9-11H,4-8,15-16H2,1-3H3
InChIKeyYNAQXPXDMHKSLV-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.99
Rot. Bonds4

About 2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine

2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine (PubChem CID 114201131) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine.

Molecular Properties

Compound Name2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine
PubChem CID114201131
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine
SMILESCC(C)CC(C)c1nc(C2CCCC2)n(N)c1N
InChIInChI=1S/C14H26N4/c1-9(2)8-10(3)12-13(15)18(16)14(17-12)11-6-4-5-7-11/h9-11H,4-8,15-16H2,1-3H3
InChIKeyYNAQXPXDMHKSLV-UHFFFAOYSA-N
XLogP2.99
TPSA69.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine?
The IUPAC name of 2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine (CID 114201131) is 2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine.
What is the SMILES notation for 2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine?
The canonical SMILES for 2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine is CC(C)CC(C)c1nc(C2CCCC2)n(N)c1N.
What is the InChIKey of 2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine?
The InChIKey is YNAQXPXDMHKSLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-9(2)8-10(3)12-13(15)18(16)14(17-12)11-6-4-5-7-11/h9-11H,4-8,15-16H2,1-3H3.
What are the key properties of 2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine?
2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine has a molecular weight of 250.39 g/mol, XLogP of 2.99, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine is sourced from PubChem (CID 114201131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).