1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine

C17H25N3 — CID 79521295

IUPAC1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine
SMILESCC(CC1CN=C(N)N1C1CCCC1)c1ccccc1
InChIInChI=1S/C17H25N3/c1-13(14-7-3-2-4-8-14)11-16-12-19-17(18)20(16)15-9-5-6-10-15/h2-4,7-8,13,15-16H,5-6,9-12H2,1H3,(H2,18,19)
InChIKeyKRCAEVWRDXIGGP-UHFFFAOYSA-N
MW271.41 g/mol
LogP3.12
Rot. Bonds4

About 1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine

1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine (PubChem CID 79521295) has the molecular formula C17H25N3 and a molecular weight of 271.41 g/mol. Its IUPAC name is 1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine
PubChem CID79521295
Molecular FormulaC17H25N3
Molecular Weight271.41 g/mol
Exact Mass271.20
IUPAC Name1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine
SMILESCC(CC1CN=C(N)N1C1CCCC1)c1ccccc1
InChIInChI=1S/C17H25N3/c1-13(14-7-3-2-4-8-14)11-16-12-19-17(18)20(16)15-9-5-6-10-15/h2-4,7-8,13,15-16H,5-6,9-12H2,1H3,(H2,18,19)
InChIKeyKRCAEVWRDXIGGP-UHFFFAOYSA-N
XLogP3.12
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.41
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine (CID 79521295) is 1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine is CC(CC1CN=C(N)N1C1CCCC1)c1ccccc1.
What is the InChIKey of 1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is KRCAEVWRDXIGGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3/c1-13(14-7-3-2-4-8-14)11-16-12-19-17(18)20(16)15-9-5-6-10-15/h2-4,7-8,13,15-16H,5-6,9-12H2,1H3,(H2,18,19).
What are the key properties of 1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine?
1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 271.41 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-5-(2-phenylpropyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79521295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).