1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide

C7H11F3N2O — CID 65465951

IUPAC1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
SMILESCN(CC(F)(F)F)C(=O)C1(N)CC1
InChIInChI=1S/C7H11F3N2O/c1-12(4-7(8,9)10)5(13)6(11)2-3-6/h2-4,11H2,1H3
InChIKeyAGMCKTLEZBPIEH-UHFFFAOYSA-N
MW196.17 g/mol
LogP0.50
Rot. Bonds2

About 1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide

1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide (PubChem CID 65465951) has the molecular formula C7H11F3N2O and a molecular weight of 196.17 g/mol. Its IUPAC name is 1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
PubChem CID65465951
Molecular FormulaC7H11F3N2O
Molecular Weight196.17 g/mol
Exact Mass196.08
IUPAC Name1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
SMILESCN(CC(F)(F)F)C(=O)C1(N)CC1
InChIInChI=1S/C7H11F3N2O/c1-12(4-7(8,9)10)5(13)6(11)2-3-6/h2-4,11H2,1H3
InChIKeyAGMCKTLEZBPIEH-UHFFFAOYSA-N
XLogP0.50
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.17
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide (CID 65465951) is 1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide is CN(CC(F)(F)F)C(=O)C1(N)CC1.
What is the InChIKey of 1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide?
The InChIKey is AGMCKTLEZBPIEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3N2O/c1-12(4-7(8,9)10)5(13)6(11)2-3-6/h2-4,11H2,1H3.
What are the key properties of 1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide?
1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide has a molecular weight of 196.17 g/mol, XLogP of 0.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-methyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 65465951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).