(Z)-5-fluoro-2-methylidenehept-3-en-1-amine

C8H14FN — CID 89090828

IUPAC(Z)-5-fluoro-2-methylidenehept-3-en-1-amine
SMILESC=C(/C=C\C(F)CC)CN
InChIInChI=1S/C8H14FN/c1-3-8(9)5-4-7(2)6-10/h4-5,8H,2-3,6,10H2,1H3/b5-4-
InChIKeyLGYDLFIHWDXMHV-PLNGDYQASA-N
MW143.20 g/mol
LogP1.81
Rot. Bonds4

About (Z)-5-fluoro-2-methylidenehept-3-en-1-amine

(Z)-5-fluoro-2-methylidenehept-3-en-1-amine (PubChem CID 89090828) has the molecular formula C8H14FN and a molecular weight of 143.20 g/mol. Its IUPAC name is (Z)-5-fluoro-2-methylidenehept-3-en-1-amine.

Molecular Properties

Compound Name(Z)-5-fluoro-2-methylidenehept-3-en-1-amine
PubChem CID89090828
Molecular FormulaC8H14FN
Molecular Weight143.20 g/mol
Exact Mass143.11
IUPAC Name(Z)-5-fluoro-2-methylidenehept-3-en-1-amine
SMILESC=C(/C=C\C(F)CC)CN
InChIInChI=1S/C8H14FN/c1-3-8(9)5-4-7(2)6-10/h4-5,8H,2-3,6,10H2,1H3/b5-4-
InChIKeyLGYDLFIHWDXMHV-PLNGDYQASA-N
XLogP1.81
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.20
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

CID 17753774
CID 17753774
3,4-Dihydrobenzylamine
CID 21950499
1-Cyclohexa-1,5-dien-1-ylethanamine
CID 91106318
3-Fluoro-4-methylcyclohexa-2,4-dien-1-amine
CID 67710936
4-Ethyl-6-fluoro-3-methylcyclohexa-2,4-dien-1-amine
CID 68084234
4-Fluoro-4-fluorobenzylamine
CID 70144286
(3,4-Difluorocyclohexa-1,5-dien-1-yl)methanamine
CID 70311731
1-(4-fluorocyclohexa-1,5-dien-1-yl)-N-methylmethanamine
CID 70372203
(1E,3Z)-4-methyl-2-(trifluoromethyl)hexa-1,3,5-trien-1-amine
CID 88063248
(2E,3E)-2-ethylidene-4-fluoro-N-methylhexa-3,5-dien-1-amine
CID 88224148
(2E)-2-[(E)-2-chloro-3-fluoroprop-1-enyl]penta-2,4-dien-1-amine
CID 88266399
(2E,4E)-5-fluoro-4-methyl-2-[(Z)-prop-1-enyl]hexa-2,4-dien-1-amine
CID 88267041

Frequently Asked Questions

What is the IUPAC name of (Z)-5-fluoro-2-methylidenehept-3-en-1-amine?
The IUPAC name of (Z)-5-fluoro-2-methylidenehept-3-en-1-amine (CID 89090828) is (Z)-5-fluoro-2-methylidenehept-3-en-1-amine.
What is the SMILES notation for (Z)-5-fluoro-2-methylidenehept-3-en-1-amine?
The canonical SMILES for (Z)-5-fluoro-2-methylidenehept-3-en-1-amine is C=C(/C=C\C(F)CC)CN.
What is the InChIKey of (Z)-5-fluoro-2-methylidenehept-3-en-1-amine?
The InChIKey is LGYDLFIHWDXMHV-PLNGDYQASA-N. The full InChI is InChI=1S/C8H14FN/c1-3-8(9)5-4-7(2)6-10/h4-5,8H,2-3,6,10H2,1H3/b5-4-.
What are the key properties of (Z)-5-fluoro-2-methylidenehept-3-en-1-amine?
(Z)-5-fluoro-2-methylidenehept-3-en-1-amine has a molecular weight of 143.20 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-fluoro-2-methylidenehept-3-en-1-amine is sourced from PubChem (CID 89090828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).