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

C7H12F3N — CID 103439929

IUPACN-propyl-1-(trifluoromethyl)cyclopropan-1-amine
SMILESCCCNC1(C(F)(F)F)CC1
InChIInChI=1S/C7H12F3N/c1-2-5-11-6(3-4-6)7(8,9)10/h11H,2-5H2,1H3
InChIKeyQAKSFNWNQNBMFC-UHFFFAOYSA-N
MW167.17 g/mol
LogP2.08
Rot. Bonds3

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

N-propyl-1-(trifluoromethyl)cyclopropan-1-amine (PubChem CID 103439929) has the molecular formula C7H12F3N and a molecular weight of 167.17 g/mol. Its IUPAC name is N-propyl-1-(trifluoromethyl)cyclopropan-1-amine.

Molecular Properties

Compound NameN-propyl-1-(trifluoromethyl)cyclopropan-1-amine
PubChem CID103439929
Molecular FormulaC7H12F3N
Molecular Weight167.17 g/mol
Exact Mass167.09
IUPAC NameN-propyl-1-(trifluoromethyl)cyclopropan-1-amine
SMILESCCCNC1(C(F)(F)F)CC1
InChIInChI=1S/C7H12F3N/c1-2-5-11-6(3-4-6)7(8,9)10/h11H,2-5H2,1H3
InChIKeyQAKSFNWNQNBMFC-UHFFFAOYSA-N
XLogP2.08
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2-difluoro-N-methylcyclopropan-1-amine hydrochloride
CID 19782780
Tert-butyl(2,2,2-trifluoroethyl)amine
CID 20626700
N-(2,2,2-trifluoroethyl)cyclopropanamine hydrochloride
CID 43810684
N-(2,2-difluoroethyl)cyclopropanamine hydrochloride
CID 50988609
N-methyl-1-(trifluoromethyl)cyclopropan-1-amine hydrochloride
CID 66570531
N-(2,2,2-Trifluoroethyl)cyclopropanamine
CID 20118971
1-(difluoromethyl)-N-methylcyclopropan-1-amine hydrochloride
CID 165460265
1,1,1,3,3,3-hexafluoro-N-propyl-2-(trifluoromethyl)propan-2-amine;hydrochloride
CID 19354702
1,1,1,3,3,3-hexafluoro-N-propyl-2-(trifluoromethyl)propan-2-amine
CID 19354703
1,1,1-trifluoro-2-methyl-N-propan-2-ylpropan-2-amine
CID 20782611
(Cyclopropylmethyl)(3,3,3-trifluoropropyl)amine
CID 21916158
(Cyclopropylmethyl)(2,2,2-trifluoroethyl)amine
CID 21916227

Frequently Asked Questions

What is the IUPAC name of N-propyl-1-(trifluoromethyl)cyclopropan-1-amine?
The IUPAC name of N-propyl-1-(trifluoromethyl)cyclopropan-1-amine (CID 103439929) is N-propyl-1-(trifluoromethyl)cyclopropan-1-amine.
What is the SMILES notation for N-propyl-1-(trifluoromethyl)cyclopropan-1-amine?
The canonical SMILES for N-propyl-1-(trifluoromethyl)cyclopropan-1-amine is CCCNC1(C(F)(F)F)CC1.
What is the InChIKey of N-propyl-1-(trifluoromethyl)cyclopropan-1-amine?
The InChIKey is QAKSFNWNQNBMFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F3N/c1-2-5-11-6(3-4-6)7(8,9)10/h11H,2-5H2,1H3.
What are the key properties of N-propyl-1-(trifluoromethyl)cyclopropan-1-amine?
N-propyl-1-(trifluoromethyl)cyclopropan-1-amine has a molecular weight of 167.17 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-(trifluoromethyl)cyclopropan-1-amine is sourced from PubChem (CID 103439929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).