2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine

C10H10F3NO — CID 22619922

IUPAC2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine
SMILESNC1CC1c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C10H10F3NO/c11-10(12,13)15-7-3-1-6(2-4-7)8-5-9(8)14/h1-4,8-9H,5,14H2
InChIKeyQMWDCTSQBQIDJC-UHFFFAOYSA-N
MW217.19 g/mol
LogP2.40
Rot. Bonds2

About 2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine

2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine (PubChem CID 22619922) has the molecular formula C10H10F3NO and a molecular weight of 217.19 g/mol. Its IUPAC name is 2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine.

Molecular Properties

Compound Name2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine
PubChem CID22619922
Molecular FormulaC10H10F3NO
Molecular Weight217.19 g/mol
Exact Mass217.07
IUPAC Name2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine
SMILESNC1CC1c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C10H10F3NO/c11-10(12,13)15-7-3-1-6(2-4-7)8-5-9(8)14/h1-4,8-9H,5,14H2
InChIKeyQMWDCTSQBQIDJC-UHFFFAOYSA-N
XLogP2.40
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.19
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1R,2R)-2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine
CID 51888219
(1S)-1-[(1R,2S)-2-[4-(trifluoromethoxy)phenyl]cyclopropyl]ethanamine
CID 29079367
cis-(1R,2S)-2-[4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxylic acid
CID 51888095
N-methyl-1-[(1S,2S)-2-[4-(trifluoromethoxy)phenyl]cyclopropyl]methanamine
CID 94558259
trans-(1R,2S)-2-[4-(trifluoromethoxy)phenyl]cyclopentan-1-ol
CID 91657528
(1S)-1-[(1S,2R)-2-[4-(trifluoromethoxy)phenyl]cyclopropyl]ethanol
CID 124747303
3-[4-(trifluoromethoxy)phenoxy]cyclobutan-1-amine;hydrochloride
CID 167609158
1-(4-fluorocyclohexyl)-4-(trifluoromethoxy)benzene
CID 23539864
N-(4-aminocyclohexyl)-N-methyl-2-[4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride
CID 86813882
2-[4-[4-(trifluoromethoxy)phenyl]phenyl]cyclopentane-1-carboxamide
CID 18006320
2-propoxy-3-[4-(trifluoromethoxy)phenoxy]cyclobutan-1-amine
CID 107943861
trans-(1R,2S)-2-(4-chlorophenyl)cyclopropan-1-amine
CID 39236206

Frequently Asked Questions

What is the IUPAC name of 2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine?
The IUPAC name of 2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine (CID 22619922) is 2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine.
What is the SMILES notation for 2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine?
The canonical SMILES for 2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine is NC1CC1c1ccc(OC(F)(F)F)cc1.
What is the InChIKey of 2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine?
The InChIKey is QMWDCTSQBQIDJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO/c11-10(12,13)15-7-3-1-6(2-4-7)8-5-9(8)14/h1-4,8-9H,5,14H2.
What are the key properties of 2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine?
2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine has a molecular weight of 217.19 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine is sourced from PubChem (CID 22619922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).