(Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine

C8H14FN — CID 131999448

IUPAC(Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine
SMILESC=C(C)N/C=C(\F)C(C)C
InChIInChI=1S/C8H14FN/c1-6(2)8(9)5-10-7(3)4/h5-6,10H,3H2,1-2,4H3/b8-5-
InChIKeyNTKIVRJHJFSAQT-YVMONPNESA-N
MW143.20 g/mol
LogP2.58
Rot. Bonds3

About (Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine

(Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine (PubChem CID 131999448) has the molecular formula C8H14FN and a molecular weight of 143.20 g/mol. Its IUPAC name is (Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine.

Molecular Properties

Compound Name(Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine
PubChem CID131999448
Molecular FormulaC8H14FN
Molecular Weight143.20 g/mol
Exact Mass143.11
IUPAC Name(Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine
SMILESC=C(C)N/C=C(\F)C(C)C
InChIInChI=1S/C8H14FN/c1-6(2)8(9)5-10-7(3)4/h5-6,10H,3H2,1-2,4H3/b8-5-
InChIKeyNTKIVRJHJFSAQT-YVMONPNESA-N
XLogP2.58
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.20
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(Z)-2-fluoro-N-prop-1-en-2-ylprop-1-en-1-amine
CID 131999490
N-(2-fluoro-2-methylpropyl)-3-methylbut-1-en-2-amine
CID 146536937
3-methyl-N-(2,2,2-trifluoroethyl)but-1-en-2-amine
CID 154671759
N-(2,2-difluoroethyl)-3-methylbut-1-en-2-amine
CID 155037031
(Z,3R)-N-buta-1,3-dien-2-yl-3-fluoro-2-methylbut-1-en-1-amine
CID 163955206
(Z)-2-N-[(Z)-but-1-enyl]-3-fluoroprop-1-ene-1,2-diamine
CID 167170172
2-fluoro-3-methyl-N-(3-methylbut-1-en-2-yl)butan-1-amine
CID 170005371
1,4-Dihydro-2,5-diisopropylpyrazine
CID 129776437
1,2-Dimethylamino-3-methyl-1-butene
CID 129810630
(Z)-N-(1-fluoroethyl)-3-methylbut-1-en-1-amine
CID 142458863
N-(2-fluoroethyl)-3-methylbut-1-en-2-amine
CID 158006518
3-methyl-N-propylbut-1-en-2-amine
CID 57654404

Frequently Asked Questions

What is the IUPAC name of (Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine?
The IUPAC name of (Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine (CID 131999448) is (Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine.
What is the SMILES notation for (Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine?
The canonical SMILES for (Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine is C=C(C)N/C=C(\F)C(C)C.
What is the InChIKey of (Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine?
The InChIKey is NTKIVRJHJFSAQT-YVMONPNESA-N. The full InChI is InChI=1S/C8H14FN/c1-6(2)8(9)5-10-7(3)4/h5-6,10H,3H2,1-2,4H3/b8-5-.
What are the key properties of (Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine?
(Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine has a molecular weight of 143.20 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-fluoro-3-methyl-N-prop-1-en-2-ylbut-1-en-1-amine is sourced from PubChem (CID 131999448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).