(Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine

C10H10F3N — CID 25013630

IUPAC(Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine
SMILESNC/C(=C\F)Cc1cc(F)ccc1F
InChIInChI=1S/C10H10F3N/c11-5-7(6-14)3-8-4-9(12)1-2-10(8)13/h1-2,4-5H,3,6,14H2/b7-5-
InChIKeyALSZGXYOBXXYHD-ALCCZGGFSA-N
MW201.19 g/mol
LogP2.32
Rot. Bonds3

About (Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine

(Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine (PubChem CID 25013630) has the molecular formula C10H10F3N and a molecular weight of 201.19 g/mol. Its IUPAC name is (Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine.

Molecular Properties

Compound Name(Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine
PubChem CID25013630
Molecular FormulaC10H10F3N
Molecular Weight201.19 g/mol
Exact Mass201.08
IUPAC Name(Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine
SMILESNC/C(=C\F)Cc1cc(F)ccc1F
InChIInChI=1S/C10H10F3N/c11-5-7(6-14)3-8-4-9(12)1-2-10(8)13/h1-2,4-5H,3,6,14H2/b7-5-
InChIKeyALSZGXYOBXXYHD-ALCCZGGFSA-N
XLogP2.32
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(Z)-3-fluoro-2-[(2-fluoro-5-methoxyphenyl)methyl]prop-2-en-1-amine
CID 58498098
(E)-3-fluoro-2-[(4-fluorophenyl)methyl]prop-2-en-1-amine
CID 66982900
2-(2,5-difluorophenyl)acetamide
CID 21245498
(2,5-difluorophenyl)methylazanium
CID 6951689
2-(2,5-difluorophenyl)acetate
CID 6951702
2-amino-N-[2-(2,5-difluorophenyl)ethyl]acetamide
CID 82492756
2-ethyl-1,4-difluorobenzene
CID 23202513
1-(2,4-difluorophenyl)-3-(2,5-difluorophenyl)propan-2-one
CID 64558874
1-chloro-3-(2,5-difluorophenyl)propan-2-one
CID 131011955
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-(2,5-difluorophenyl)acetamide
CID 115271338
2-[2-[(2,5-difluorophenyl)methoxy]-5-fluorophenyl]ethanamine
CID 107700281
N'-[2-(2,5-difluorophenyl)ethyl]ethane-1,2-diamine
CID 115195405

Frequently Asked Questions

What is the IUPAC name of (Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine?
The IUPAC name of (Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine (CID 25013630) is (Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine.
What is the SMILES notation for (Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine?
The canonical SMILES for (Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine is NC/C(=C\F)Cc1cc(F)ccc1F.
What is the InChIKey of (Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine?
The InChIKey is ALSZGXYOBXXYHD-ALCCZGGFSA-N. The full InChI is InChI=1S/C10H10F3N/c11-5-7(6-14)3-8-4-9(12)1-2-10(8)13/h1-2,4-5H,3,6,14H2/b7-5-.
What are the key properties of (Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine?
(Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine has a molecular weight of 201.19 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-[(2,5-difluorophenyl)methyl]-3-fluoroprop-2-en-1-amine is sourced from PubChem (CID 25013630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).