(E)-3-fluoropent-3-ene-1,4-diamine

C5H11FN2 — CID 89419025

IUPAC(E)-3-fluoropent-3-ene-1,4-diamine
SMILESC/C(N)=C(\F)CCN
InChIInChI=1S/C5H11FN2/c1-4(8)5(6)2-3-7/h2-3,7-8H2,1H3/b5-4+
InChIKeyOFUUUPPCXKDZOU-SNAWJCMRSA-N
MW118.15 g/mol
LogP0.49
Rot. Bonds2

About (E)-3-fluoropent-3-ene-1,4-diamine

(E)-3-fluoropent-3-ene-1,4-diamine (PubChem CID 89419025) has the molecular formula C5H11FN2 and a molecular weight of 118.15 g/mol. Its IUPAC name is (E)-3-fluoropent-3-ene-1,4-diamine.

Molecular Properties

Compound Name(E)-3-fluoropent-3-ene-1,4-diamine
PubChem CID89419025
Molecular FormulaC5H11FN2
Molecular Weight118.15 g/mol
Exact Mass118.09
IUPAC Name(E)-3-fluoropent-3-ene-1,4-diamine
SMILESC/C(N)=C(\F)CCN
InChIInChI=1S/C5H11FN2/c1-4(8)5(6)2-3-7/h2-3,7-8H2,1H3/b5-4+
InChIKeyOFUUUPPCXKDZOU-SNAWJCMRSA-N
XLogP0.49
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.15
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(e)-a-(Fluoromethyl)dehydroputrescine
CID 129817213
(E)-2-fluoropent-2-en-3-amine
CID 89416415
(Z)-3-fluoro-N-methylpent-2-en-2-amine
CID 89419652
(Z)-3-fluoropent-2-en-2-amine
CID 118312295
(Z)-2-fluoropent-2-en-3-amine
CID 131973676
(Z)-4-fluorohex-3-en-3-amine
CID 131973678
(E)-3-fluoro-4-N-methylpent-2-ene-2,4-diamine
CID 146384681
(Z)-5-fluorohept-5-ene-1,6-diamine
CID 164114720
(E)-3-fluoropent-2-ene-1,2-diamine
CID 167222079
(Z)-hex-3-ene-2,3,4-triamine
CID 163873285
4-Methylpent-3-ene-1,3-diamine
CID 167052485
(E)-3-methylpent-3-ene-1,4-diamine
CID 88212431

Frequently Asked Questions

What is the IUPAC name of (E)-3-fluoropent-3-ene-1,4-diamine?
The IUPAC name of (E)-3-fluoropent-3-ene-1,4-diamine (CID 89419025) is (E)-3-fluoropent-3-ene-1,4-diamine.
What is the SMILES notation for (E)-3-fluoropent-3-ene-1,4-diamine?
The canonical SMILES for (E)-3-fluoropent-3-ene-1,4-diamine is C/C(N)=C(\F)CCN.
What is the InChIKey of (E)-3-fluoropent-3-ene-1,4-diamine?
The InChIKey is OFUUUPPCXKDZOU-SNAWJCMRSA-N. The full InChI is InChI=1S/C5H11FN2/c1-4(8)5(6)2-3-7/h2-3,7-8H2,1H3/b5-4+.
What are the key properties of (E)-3-fluoropent-3-ene-1,4-diamine?
(E)-3-fluoropent-3-ene-1,4-diamine has a molecular weight of 118.15 g/mol, XLogP of 0.49, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-fluoropent-3-ene-1,4-diamine is sourced from PubChem (CID 89419025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).