N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide

C8H12F3NO — CID 89207499

IUPACN-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide
SMILESCC(C)NC(=O)C1(C(F)(F)F)CC1
InChIInChI=1S/C8H12F3NO/c1-5(2)12-6(13)7(3-4-7)8(9,10)11/h5H,3-4H2,1-2H3,(H,12,13)
InChIKeyIUFDHDUZWCDEMD-UHFFFAOYSA-N
MW195.18 g/mol
LogP1.85
Rot. Bonds2

About N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide

N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide (PubChem CID 89207499) has the molecular formula C8H12F3NO and a molecular weight of 195.18 g/mol. Its IUPAC name is N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide
PubChem CID89207499
Molecular FormulaC8H12F3NO
Molecular Weight195.18 g/mol
Exact Mass195.09
IUPAC NameN-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide
SMILESCC(C)NC(=O)C1(C(F)(F)F)CC1
InChIInChI=1S/C8H12F3NO/c1-5(2)12-6(13)7(3-4-7)8(9,10)11/h5H,3-4H2,1-2H3,(H,12,13)
InChIKeyIUFDHDUZWCDEMD-UHFFFAOYSA-N
XLogP1.85
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.18
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide?
The IUPAC name of N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide (CID 89207499) is N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide is CC(C)NC(=O)C1(C(F)(F)F)CC1.
What is the InChIKey of N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide?
The InChIKey is IUFDHDUZWCDEMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F3NO/c1-5(2)12-6(13)7(3-4-7)8(9,10)11/h5H,3-4H2,1-2H3,(H,12,13).
What are the key properties of N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide?
N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide has a molecular weight of 195.18 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-1-(trifluoromethyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 89207499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).