(Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine

C11H19F2N — CID 144510948

IUPAC(Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine
SMILESC=C(/C(=C\N(C)CC)CC)C(C)(F)F
InChIInChI=1S/C11H19F2N/c1-6-10(8-14(5)7-2)9(3)11(4,12)13/h8H,3,6-7H2,1-2,4-5H3/b10-8-
InChIKeyTUPMLHZQEHOUDK-NTMALXAHSA-N
MW203.28 g/mol
LogP3.44
Rot. Bonds5

About (Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine

(Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine (PubChem CID 144510948) has the molecular formula C11H19F2N and a molecular weight of 203.28 g/mol. Its IUPAC name is (Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine
PubChem CID144510948
Molecular FormulaC11H19F2N
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC Name(Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine
SMILESC=C(/C(=C\N(C)CC)CC)C(C)(F)F
InChIInChI=1S/C11H19F2N/c1-6-10(8-14(5)7-2)9(3)11(4,12)13/h8H,3,6-7H2,1-2,4-5H3/b10-8-
InChIKeyTUPMLHZQEHOUDK-NTMALXAHSA-N
XLogP3.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine?
The IUPAC name of (Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine (CID 144510948) is (Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine.
What is the SMILES notation for (Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine?
The canonical SMILES for (Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine is C=C(/C(=C\N(C)CC)CC)C(C)(F)F.
What is the InChIKey of (Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine?
The InChIKey is TUPMLHZQEHOUDK-NTMALXAHSA-N. The full InChI is InChI=1S/C11H19F2N/c1-6-10(8-14(5)7-2)9(3)11(4,12)13/h8H,3,6-7H2,1-2,4-5H3/b10-8-.
What are the key properties of (Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine?
(Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine has a molecular weight of 203.28 g/mol, XLogP of 3.44, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,2-diethyl-4,4-difluoro-N-methyl-3-methylidenepent-1-en-1-amine is sourced from PubChem (CID 144510948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).