2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine

C14H15F2N3 — CID 62220925

IUPAC2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine
SMILESCCn1c(C2CC2)nc(-c2ccc(F)c(F)c2)c1N
InChIInChI=1S/C14H15F2N3/c1-2-19-13(17)12(18-14(19)8-3-4-8)9-5-6-10(15)11(16)7-9/h5-8H,2-4,17H2,1H3
InChIKeySVLVWBKSOJRQHA-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.31
Rot. Bonds3

About 2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine

2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine (PubChem CID 62220925) has the molecular formula C14H15F2N3 and a molecular weight of 263.29 g/mol. Its IUPAC name is 2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine
PubChem CID62220925
Molecular FormulaC14H15F2N3
Molecular Weight263.29 g/mol
Exact Mass263.12
IUPAC Name2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine
SMILESCCn1c(C2CC2)nc(-c2ccc(F)c(F)c2)c1N
InChIInChI=1S/C14H15F2N3/c1-2-19-13(17)12(18-14(19)8-3-4-8)9-5-6-10(15)11(16)7-9/h5-8H,2-4,17H2,1H3
InChIKeySVLVWBKSOJRQHA-UHFFFAOYSA-N
XLogP3.31
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine?
The IUPAC name of 2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine (CID 62220925) is 2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine.
What is the SMILES notation for 2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine?
The canonical SMILES for 2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine is CCn1c(C2CC2)nc(-c2ccc(F)c(F)c2)c1N.
What is the InChIKey of 2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine?
The InChIKey is SVLVWBKSOJRQHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2N3/c1-2-19-13(17)12(18-14(19)8-3-4-8)9-5-6-10(15)11(16)7-9/h5-8H,2-4,17H2,1H3.
What are the key properties of 2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine?
2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine has a molecular weight of 263.29 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine is sourced from PubChem (CID 62220925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).