1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine

C14H16FN3 — CID 106558725

IUPAC1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine
SMILESFc1ccc(Nc2nccn2C2CCCC2)cc1
InChIInChI=1S/C14H16FN3/c15-11-5-7-12(8-6-11)17-14-16-9-10-18(14)13-3-1-2-4-13/h5-10,13H,1-4H2,(H,16,17)
InChIKeyRWQVBUHIEMVMGC-UHFFFAOYSA-N
MW245.30 g/mol
LogP3.88
Rot. Bonds3

About 1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine

1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine (PubChem CID 106558725) has the molecular formula C14H16FN3 and a molecular weight of 245.30 g/mol. Its IUPAC name is 1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine
PubChem CID106558725
Molecular FormulaC14H16FN3
Molecular Weight245.30 g/mol
Exact Mass245.13
IUPAC Name1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine
SMILESFc1ccc(Nc2nccn2C2CCCC2)cc1
InChIInChI=1S/C14H16FN3/c15-11-5-7-12(8-6-11)17-14-16-9-10-18(14)13-3-1-2-4-13/h5-10,13H,1-4H2,(H,16,17)
InChIKeyRWQVBUHIEMVMGC-UHFFFAOYSA-N
XLogP3.88
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine?
The IUPAC name of 1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine (CID 106558725) is 1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine.
What is the SMILES notation for 1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine?
The canonical SMILES for 1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine is Fc1ccc(Nc2nccn2C2CCCC2)cc1.
What is the InChIKey of 1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine?
The InChIKey is RWQVBUHIEMVMGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3/c15-11-5-7-12(8-6-11)17-14-16-9-10-18(14)13-3-1-2-4-13/h5-10,13H,1-4H2,(H,16,17).
What are the key properties of 1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine?
1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine has a molecular weight of 245.30 g/mol, XLogP of 3.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-(4-fluorophenyl)imidazol-2-amine is sourced from PubChem (CID 106558725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).