1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine

C10H16FN3 — CID 105450776

IUPAC1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine
SMILESNC1(CCc2cncn2CCF)CC1
InChIInChI=1S/C10H16FN3/c11-5-6-14-8-13-7-9(14)1-2-10(12)3-4-10/h7-8H,1-6,12H2
InChIKeyQFOXJGDHRRCWBM-UHFFFAOYSA-N
MW197.26 g/mol
LogP1.28
Rot. Bonds5

About 1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine

1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine (PubChem CID 105450776) has the molecular formula C10H16FN3 and a molecular weight of 197.26 g/mol. Its IUPAC name is 1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine
PubChem CID105450776
Molecular FormulaC10H16FN3
Molecular Weight197.26 g/mol
Exact Mass197.13
IUPAC Name1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine
SMILESNC1(CCc2cncn2CCF)CC1
InChIInChI=1S/C10H16FN3/c11-5-6-14-8-13-7-9(14)1-2-10(12)3-4-10/h7-8H,1-6,12H2
InChIKeyQFOXJGDHRRCWBM-UHFFFAOYSA-N
XLogP1.28
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.26
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine?
The IUPAC name of 1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine (CID 105450776) is 1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine?
The canonical SMILES for 1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine is NC1(CCc2cncn2CCF)CC1.
What is the InChIKey of 1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine?
The InChIKey is QFOXJGDHRRCWBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FN3/c11-5-6-14-8-13-7-9(14)1-2-10(12)3-4-10/h7-8H,1-6,12H2.
What are the key properties of 1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine?
1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine has a molecular weight of 197.26 g/mol, XLogP of 1.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[3-(2-fluoroethyl)imidazol-4-yl]ethyl]cyclopropan-1-amine is sourced from PubChem (CID 105450776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).