1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine

C15H25N5 — CID 79498756

IUPAC1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine
SMILESCCn1cncc1C1CN=C(N)N1C1CCCCCC1
InChIInChI=1S/C15H25N5/c1-2-19-11-17-9-13(19)14-10-18-15(16)20(14)12-7-5-3-4-6-8-12/h9,11-12,14H,2-8,10H2,1H3,(H2,16,18)
InChIKeyOZWHAMLUMBPEHO-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.30
Rot. Bonds3

About 1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine

1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine (PubChem CID 79498756) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is 1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine
PubChem CID79498756
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine
SMILESCCn1cncc1C1CN=C(N)N1C1CCCCCC1
InChIInChI=1S/C15H25N5/c1-2-19-11-17-9-13(19)14-10-18-15(16)20(14)12-7-5-3-4-6-8-12/h9,11-12,14H,2-8,10H2,1H3,(H2,16,18)
InChIKeyOZWHAMLUMBPEHO-UHFFFAOYSA-N
XLogP2.30
TPSA59.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine (CID 79498756) is 1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine is CCn1cncc1C1CN=C(N)N1C1CCCCCC1.
What is the InChIKey of 1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine?
The InChIKey is OZWHAMLUMBPEHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-2-19-11-17-9-13(19)14-10-18-15(16)20(14)12-7-5-3-4-6-8-12/h9,11-12,14H,2-8,10H2,1H3,(H2,16,18).
What are the key properties of 1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine?
1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine has a molecular weight of 275.40 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-5-(3-ethylimidazol-4-yl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79498756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).