3-cyclopropyl-2-fluorobenzamide

C10H10FNO — CID 66666375

IUPAC3-cyclopropyl-2-fluorobenzamide
SMILESNC(=O)c1cccc(C2CC2)c1F
InChIInChI=1S/C10H10FNO/c11-9-7(6-4-5-6)2-1-3-8(9)10(12)13/h1-3,6H,4-5H2,(H2,12,13)
InChIKeyAYFGIGLKRFNJDU-UHFFFAOYSA-N
MW179.19 g/mol
LogP1.80
Rot. Bonds2

About 3-cyclopropyl-2-fluorobenzamide

3-cyclopropyl-2-fluorobenzamide (PubChem CID 66666375) has the molecular formula C10H10FNO and a molecular weight of 179.19 g/mol. Its IUPAC name is 3-cyclopropyl-2-fluorobenzamide.

Molecular Properties

Compound Name3-cyclopropyl-2-fluorobenzamide
PubChem CID66666375
Molecular FormulaC10H10FNO
Molecular Weight179.19 g/mol
Exact Mass179.07
IUPAC Name3-cyclopropyl-2-fluorobenzamide
SMILESNC(=O)c1cccc(C2CC2)c1F
InChIInChI=1S/C10H10FNO/c11-9-7(6-4-5-6)2-1-3-8(9)10(12)13/h1-3,6H,4-5H2,(H2,12,13)
InChIKeyAYFGIGLKRFNJDU-UHFFFAOYSA-N
XLogP1.80
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.19
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-2-fluorobenzamide?
The IUPAC name of 3-cyclopropyl-2-fluorobenzamide (CID 66666375) is 3-cyclopropyl-2-fluorobenzamide.
What is the SMILES notation for 3-cyclopropyl-2-fluorobenzamide?
The canonical SMILES for 3-cyclopropyl-2-fluorobenzamide is NC(=O)c1cccc(C2CC2)c1F.
What is the InChIKey of 3-cyclopropyl-2-fluorobenzamide?
The InChIKey is AYFGIGLKRFNJDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO/c11-9-7(6-4-5-6)2-1-3-8(9)10(12)13/h1-3,6H,4-5H2,(H2,12,13).
What are the key properties of 3-cyclopropyl-2-fluorobenzamide?
3-cyclopropyl-2-fluorobenzamide has a molecular weight of 179.19 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-2-fluorobenzamide is sourced from PubChem (CID 66666375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).