N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine

C7H10F3N — CID 88598252

IUPACN-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine
SMILESC=CCN(CC=C)C(F)(F)F
InChIInChI=1S/C7H10F3N/c1-3-5-11(6-4-2)7(8,9)10/h3-4H,1-2,5-6H2
InChIKeyXFQUONOSTWXAIB-UHFFFAOYSA-N
MW165.16 g/mol
LogP2.18
Rot. Bonds4

About N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine

N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine (PubChem CID 88598252) has the molecular formula C7H10F3N and a molecular weight of 165.16 g/mol. Its IUPAC name is N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine.

Molecular Properties

Compound NameN-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine
PubChem CID88598252
Molecular FormulaC7H10F3N
Molecular Weight165.16 g/mol
Exact Mass165.08
IUPAC NameN-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine
SMILESC=CCN(CC=C)C(F)(F)F
InChIInChI=1S/C7H10F3N/c1-3-5-11(6-4-2)7(8,9)10/h3-4H,1-2,5-6H2
InChIKeyXFQUONOSTWXAIB-UHFFFAOYSA-N
XLogP2.18
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.16
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

N,N-Bis(trifluoromethyl)prop-2-en-1-amine
CID 57920871
N-(3,3-difluoroallyl)-diethylamine
CID 129878552
1,1,2,3,3,3-hexafluoro-N,N-bis(prop-2-enyl)propan-1-amine
CID 13569481
N-methyl-N-(trifluoromethyl)prop-2-en-1-amine
CID 58019336
N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine
CID 59155105
N-prop-2-enyl-N-(trifluoromethylsulfanyl)prop-2-en-1-amine
CID 87157551
1-Fluoroprop-2-enyl-tris(prop-2-enyl)azanium
CID 88095234
1,1-difluoro-N,N-dimethylprop-2-en-1-amine
CID 121361161
N-(2,2-difluoroethyl)-N-methylprop-2-en-1-amine
CID 130670085
N-(2-fluoroethyl)-N-prop-2-enylprop-2-en-1-amine
CID 130701613
N-(2-fluoroethyl)-N-methylprop-2-en-1-amine
CID 131108623
trimethyl-[(Z)-3,4,4-trifluorobut-2-enyl]azanium
CID 135270741

Frequently Asked Questions

What is the IUPAC name of N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine?
The IUPAC name of N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine (CID 88598252) is N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine.
What is the SMILES notation for N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine?
The canonical SMILES for N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine is C=CCN(CC=C)C(F)(F)F.
What is the InChIKey of N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine?
The InChIKey is XFQUONOSTWXAIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F3N/c1-3-5-11(6-4-2)7(8,9)10/h3-4H,1-2,5-6H2.
What are the key properties of N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine?
N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine has a molecular weight of 165.16 g/mol, XLogP of 2.18, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine is sourced from PubChem (CID 88598252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).