6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine

C14H27FN2 — CID 143222319

IUPAC6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine
SMILESC=NCNCCCCC(C)C(C=CCC)CF
InChIInChI=1S/C14H27FN2/c1-4-5-9-14(11-15)13(2)8-6-7-10-17-12-16-3/h5,9,13-14,17H,3-4,6-8,10-12H2,1-2H3
InChIKeyPKBNJTGFRHDQPH-UHFFFAOYSA-N
MW242.38 g/mol
LogP3.59
Rot. Bonds11

About 6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine

6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine (PubChem CID 143222319) has the molecular formula C14H27FN2 and a molecular weight of 242.38 g/mol. Its IUPAC name is 6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine.

Molecular Properties

Compound Name6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine
PubChem CID143222319
Molecular FormulaC14H27FN2
Molecular Weight242.38 g/mol
Exact Mass242.22
IUPAC Name6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine
SMILESC=NCNCCCCC(C)C(C=CCC)CF
InChIInChI=1S/C14H27FN2/c1-4-5-9-14(11-15)13(2)8-6-7-10-17-12-16-3/h5,9,13-14,17H,3-4,6-8,10-12H2,1-2H3
InChIKeyPKBNJTGFRHDQPH-UHFFFAOYSA-N
XLogP3.59
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.38
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine?
The IUPAC name of 6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine (CID 143222319) is 6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine.
What is the SMILES notation for 6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine?
The canonical SMILES for 6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine is C=NCNCCCCC(C)C(C=CCC)CF.
What is the InChIKey of 6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine?
The InChIKey is PKBNJTGFRHDQPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27FN2/c1-4-5-9-14(11-15)13(2)8-6-7-10-17-12-16-3/h5,9,13-14,17H,3-4,6-8,10-12H2,1-2H3.
What are the key properties of 6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine?
6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine has a molecular weight of 242.38 g/mol, XLogP of 3.59, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(fluoromethyl)-5-methyl-N-[(methylideneamino)methyl]dec-7-en-1-amine is sourced from PubChem (CID 143222319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).