(Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine

C11H17F2N — CID 143588764

IUPAC(Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine
SMILES[H]/N=C(\C=C/C(=C)CCC)CC(C)(F)F
InChIInChI=1S/C11H17F2N/c1-4-5-9(2)6-7-10(14)8-11(3,12)13/h6-7,14H,2,4-5,8H2,1,3H3/b7-6-,14-10+
InChIKeyNZHNLROURDUREX-KOORZVIOSA-N
MW201.26 g/mol
LogP3.96
Rot. Bonds6

About (Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine

(Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine (PubChem CID 143588764) has the molecular formula C11H17F2N and a molecular weight of 201.26 g/mol. Its IUPAC name is (Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine.

Molecular Properties

Compound Name(Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine
PubChem CID143588764
Molecular FormulaC11H17F2N
Molecular Weight201.26 g/mol
Exact Mass201.13
IUPAC Name(Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine
SMILES[H]/N=C(\C=C/C(=C)CCC)CC(C)(F)F
InChIInChI=1S/C11H17F2N/c1-4-5-9(2)6-7-10(14)8-11(3,12)13/h6-7,14H,2,4-5,8H2,1,3H3/b7-6-,14-10+
InChIKeyNZHNLROURDUREX-KOORZVIOSA-N
XLogP3.96
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.26
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine?
The IUPAC name of (Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine (CID 143588764) is (Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine.
What is the SMILES notation for (Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine?
The canonical SMILES for (Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine is [H]/N=C(\C=C/C(=C)CCC)CC(C)(F)F.
What is the InChIKey of (Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine?
The InChIKey is NZHNLROURDUREX-KOORZVIOSA-N. The full InChI is InChI=1S/C11H17F2N/c1-4-5-9(2)6-7-10(14)8-11(3,12)13/h6-7,14H,2,4-5,8H2,1,3H3/b7-6-,14-10+.
What are the key properties of (Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine?
(Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine has a molecular weight of 201.26 g/mol, XLogP of 3.96, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine is sourced from PubChem (CID 143588764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).