N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine

C9H14F3N — CID 106210350

IUPACN-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine
SMILESCC(NC1(C(F)(F)F)CC1)C1CC1
InChIInChI=1S/C9H14F3N/c1-6(7-2-3-7)13-8(4-5-8)9(10,11)12/h6-7,13H,2-5H2,1H3
InChIKeyKKJVJVDDUHMDNC-UHFFFAOYSA-N
MW193.21 g/mol
LogP2.47
Rot. Bonds3

About N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine

N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine (PubChem CID 106210350) has the molecular formula C9H14F3N and a molecular weight of 193.21 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine
PubChem CID106210350
Molecular FormulaC9H14F3N
Molecular Weight193.21 g/mol
Exact Mass193.11
IUPAC NameN-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine
SMILESCC(NC1(C(F)(F)F)CC1)C1CC1
InChIInChI=1S/C9H14F3N/c1-6(7-2-3-7)13-8(4-5-8)9(10,11)12/h6-7,13H,2-5H2,1H3
InChIKeyKKJVJVDDUHMDNC-UHFFFAOYSA-N
XLogP2.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-carbamoyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide
CID 106212536
N-(2,6-dimethylheptan-4-yl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 114158562
N-[1-(5-bromothiophen-2-yl)ethyl]-1-(trifluoromethyl)cyclopropan-1-amine
CID 106210270
N-(1-methoxypropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 106210147
N-(1-piperidin-2-ylpropan-2-yl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 114158626
N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide
CID 106212233
N-[1-(1-benzothiophen-2-yl)ethyl]-1-(trifluoromethyl)cyclopropan-1-amine
CID 106210192
4-tert-butyl-N-ethyl-1-(trifluoromethyl)cyclohexan-1-amine
CID 66207204
N-[1-(3-methylpyrazin-2-yl)ethyl]-1-(trifluoromethyl)cyclopropan-1-amine
CID 106210712
N-[1-(5-bromofuran-2-yl)ethyl]-1-(trifluoromethyl)cyclopropan-1-amine
CID 106210586
N-butan-2-yl-2-[[1-(trifluoromethyl)cyclopropyl]amino]propanamide
CID 106212364
N-(thiolan-3-ylmethyl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 106210917

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine?
The IUPAC name of N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine (CID 106210350) is N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine?
The canonical SMILES for N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine is CC(NC1(C(F)(F)F)CC1)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine?
The InChIKey is KKJVJVDDUHMDNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14F3N/c1-6(7-2-3-7)13-8(4-5-8)9(10,11)12/h6-7,13H,2-5H2,1H3.
What are the key properties of N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine?
N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine has a molecular weight of 193.21 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-1-(trifluoromethyl)cyclopropan-1-amine is sourced from PubChem (CID 106210350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).