N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine

C8H14F3NO — CID 106210147

IUPACN-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine
SMILESCOCC(C)NC1(C(F)(F)F)CC1
InChIInChI=1S/C8H14F3NO/c1-6(5-13-2)12-7(3-4-7)8(9,10)11/h6,12H,3-5H2,1-2H3
InChIKeyPXJRIOZNFDJYJT-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.71
Rot. Bonds4

About N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine

N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine (PubChem CID 106210147) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine
PubChem CID106210147
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC NameN-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine
SMILESCOCC(C)NC1(C(F)(F)F)CC1
InChIInChI=1S/C8H14F3NO/c1-6(5-13-2)12-7(3-4-7)8(9,10)11/h6,12H,3-5H2,1-2H3
InChIKeyPXJRIOZNFDJYJT-UHFFFAOYSA-N
XLogP1.71
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-dimethylheptan-4-yl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 114158562
N-butan-2-yl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide
CID 106212364
N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide
CID 106212233
N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 106210350
N-(2-methoxyethyl)-N'-[1-(trifluoromethyl)cyclopropyl]ethane-1,2-diamine
CID 106219170
(2S)-1-methoxy-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 28571144
N-(1-methoxypropan-2-yl)-1-phenylcyclopropan-1-amine
CID 115920179
N-carbamoyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide
CID 106212536
1-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)cyclopropan-1-amine
CID 115920775
1-(2-methylpropoxy)-3-[[1-(trifluoromethyl)cyclopropyl]amino]propan-2-ol
CID 106212542
3-amino-2-methoxy-N-[1-(trifluoromethyl)cyclopropyl]propanamide
CID 106213280
3-amino-2-methyl-N-[1-(trifluoromethyl)cyclopropyl]propanamide
CID 106213177

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine?
The IUPAC name of N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine (CID 106210147) is N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine?
The canonical SMILES for N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine is COCC(C)NC1(C(F)(F)F)CC1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine?
The InChIKey is PXJRIOZNFDJYJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c1-6(5-13-2)12-7(3-4-7)8(9,10)11/h6,12H,3-5H2,1-2H3.
What are the key properties of N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine?
N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine has a molecular weight of 197.20 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine is sourced from PubChem (CID 106210147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).