5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine

C15H20ClN3O — CID 79521731

IUPAC5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine
SMILESCOc1ccc(C2CN=C(N)N2C2CCCC2)cc1Cl
InChIInChI=1S/C15H20ClN3O/c1-20-14-7-6-10(8-12(14)16)13-9-18-15(17)19(13)11-4-2-3-5-11/h6-8,11,13H,2-5,9H2,1H3,(H2,17,18)
InChIKeyYKYHIBPHDHNPRL-UHFFFAOYSA-N
MW293.80 g/mol
LogP2.96
Rot. Bonds3

About 5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine

5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine (PubChem CID 79521731) has the molecular formula C15H20ClN3O and a molecular weight of 293.80 g/mol. Its IUPAC name is 5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine
PubChem CID79521731
Molecular FormulaC15H20ClN3O
Molecular Weight293.80 g/mol
Exact Mass293.13
IUPAC Name5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine
SMILESCOc1ccc(C2CN=C(N)N2C2CCCC2)cc1Cl
InChIInChI=1S/C15H20ClN3O/c1-20-14-7-6-10(8-12(14)16)13-9-18-15(17)19(13)11-4-2-3-5-11/h6-8,11,13H,2-5,9H2,1H3,(H2,17,18)
InChIKeyYKYHIBPHDHNPRL-UHFFFAOYSA-N
XLogP2.96
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.80
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine (CID 79521731) is 5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine is COc1ccc(C2CN=C(N)N2C2CCCC2)cc1Cl.
What is the InChIKey of 5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine?
The InChIKey is YKYHIBPHDHNPRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O/c1-20-14-7-6-10(8-12(14)16)13-9-18-15(17)19(13)11-4-2-3-5-11/h6-8,11,13H,2-5,9H2,1H3,(H2,17,18).
What are the key properties of 5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine?
5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine has a molecular weight of 293.80 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-chloro-4-methoxyphenyl)-1-cyclopentyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79521731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).