N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide

C8H13F3N2O — CID 106212233

IUPACN-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide
SMILESCNC(=O)C(C)NC1(C(F)(F)F)CC1
InChIInChI=1S/C8H13F3N2O/c1-5(6(14)12-2)13-7(3-4-7)8(9,10)11/h5,13H,3-4H2,1-2H3,(H,12,14)
InChIKeyRQSFHGBHQMOWBB-UHFFFAOYSA-N
MW210.20 g/mol
LogP0.81
Rot. Bonds3

About N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide

N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide (PubChem CID 106212233) has the molecular formula C8H13F3N2O and a molecular weight of 210.20 g/mol. Its IUPAC name is N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide.

Molecular Properties

Compound NameN-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide
PubChem CID106212233
Molecular FormulaC8H13F3N2O
Molecular Weight210.20 g/mol
Exact Mass210.10
IUPAC NameN-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide
SMILESCNC(=O)C(C)NC1(C(F)(F)F)CC1
InChIInChI=1S/C8H13F3N2O/c1-5(6(14)12-2)13-7(3-4-7)8(9,10)11/h5,13H,3-4H2,1-2H3,(H,12,14)
InChIKeyRQSFHGBHQMOWBB-UHFFFAOYSA-N
XLogP0.81
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.20
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-carbamoyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide
CID 106212536
N-butan-2-yl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide
CID 106212364
(2S)-2-amino-N-[1-(trifluoromethyl)cyclopropyl]propanamide
CID 106213284
2-methyl-3-oxo-3-[[1-(trifluoromethyl)cyclopropyl]amino]propanoic acid
CID 106216719
2-cyano-3-methyl-N-[1-(trifluoromethyl)cyclopropyl]butanamide
CID 106213496
3-amino-2-methyl-N-[1-(trifluoromethyl)cyclopropyl]propanamide
CID 106213177
N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 106210147
3-methyl-N-[1-(trifluoromethyl)cyclopropyl]butanamide
CID 176873148
N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 106210350
2-fluoro-2-methyl-N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]propanamide
CID 130683456
N-(2,6-dimethylheptan-4-yl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 114158562
2-[(2-bromo-2,2-difluoroacetyl)amino]-N-methylpropanamide
CID 130710592

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide?
The IUPAC name of N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide (CID 106212233) is N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide.
What is the SMILES notation for N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide?
The canonical SMILES for N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide is CNC(=O)C(C)NC1(C(F)(F)F)CC1.
What is the InChIKey of N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide?
The InChIKey is RQSFHGBHQMOWBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F3N2O/c1-5(6(14)12-2)13-7(3-4-7)8(9,10)11/h5,13H,3-4H2,1-2H3,(H,12,14).
What are the key properties of N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide?
N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide has a molecular weight of 210.20 g/mol, XLogP of 0.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide is sourced from PubChem (CID 106212233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).