(Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine

C9H16FN — CID 143551208

IUPAC(Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine
SMILESC=C(/C(C)=C\N(C)C)C(C)F
InChIInChI=1S/C9H16FN/c1-7(6-11(4)5)8(2)9(3)10/h6,9H,2H2,1,3-5H3/b7-6-
InChIKeyPJDZKIBUJJDDKU-SREVYHEPSA-N
MW157.23 g/mol
LogP2.37
Rot. Bonds3

About (Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine

(Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine (PubChem CID 143551208) has the molecular formula C9H16FN and a molecular weight of 157.23 g/mol. Its IUPAC name is (Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine.

Molecular Properties

Compound Name(Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine
PubChem CID143551208
Molecular FormulaC9H16FN
Molecular Weight157.23 g/mol
Exact Mass157.13
IUPAC Name(Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine
SMILESC=C(/C(C)=C\N(C)C)C(C)F
InChIInChI=1S/C9H16FN/c1-7(6-11(4)5)8(2)9(3)10/h6,9H,2H2,1,3-5H3/b7-6-
InChIKeyPJDZKIBUJJDDKU-SREVYHEPSA-N
XLogP2.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.23
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-ethyl-N,N-dimethylbut-1-en-1-amine
CID 101374933
(1Z)-2-tert-butyl-3-fluoro-N,N-dimethylbuta-1,3-dien-1-amine
CID 126549239
(E)-1-fluoro-N,N-dimethyl-3-methylidenehex-1-en-1-amine
CID 143551187
(Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine;ethane
CID 144510947
(Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine
CID 146226342
1,5-dimethyl-4-methylidene-3-(trifluoromethyl)-2H-pyridin-2-ide;yttrium
CID 149561330
(1Z)-2-ethyl-3-(fluoromethyl)-N,N-dimethylbuta-1,3-dien-1-amine
CID 154937376
(1E)-N-(2-fluoroethyl)-N,2,6-trimethylhepta-1,6-dien-1-amine
CID 155274989
(Z)-N-ethyl-6-fluoro-N,2-dimethyl-3-methylidenehept-1-en-1-amine
CID 156230267
(1Z)-N-(1-fluoroethyl)-N,2-dimethylbuta-1,3-dien-1-amine
CID 167154099
(Z)-3-fluoro-N,N,2-trimethylbut-1-en-1-amine
CID 169625009
1-Diethylamino-2-methyl-1-pentene
CID 129663481

Frequently Asked Questions

What is the IUPAC name of (Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine?
The IUPAC name of (Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine (CID 143551208) is (Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine.
What is the SMILES notation for (Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine?
The canonical SMILES for (Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine is C=C(/C(C)=C\N(C)C)C(C)F.
What is the InChIKey of (Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine?
The InChIKey is PJDZKIBUJJDDKU-SREVYHEPSA-N. The full InChI is InChI=1S/C9H16FN/c1-7(6-11(4)5)8(2)9(3)10/h6,9H,2H2,1,3-5H3/b7-6-.
What are the key properties of (Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine?
(Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine has a molecular weight of 157.23 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-fluoro-N,N,2-trimethyl-3-methylidenepent-1-en-1-amine is sourced from PubChem (CID 143551208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).