1,1,1-trifluoro-N-methylnon-8-en-2-amine

C10H18F3N — CID 107011900

IUPAC1,1,1-trifluoro-N-methylnon-8-en-2-amine
SMILESC=CCCCCCC(NC)C(F)(F)F
InChIInChI=1S/C10H18F3N/c1-3-4-5-6-7-8-9(14-2)10(11,12)13/h3,9,14H,1,4-8H2,2H3
InChIKeyPNHBNHOHWIKMMO-UHFFFAOYSA-N
MW209.25 g/mol
LogP3.27
Rot. Bonds7

About 1,1,1-trifluoro-N-methylnon-8-en-2-amine

1,1,1-trifluoro-N-methylnon-8-en-2-amine (PubChem CID 107011900) has the molecular formula C10H18F3N and a molecular weight of 209.25 g/mol. Its IUPAC name is 1,1,1-trifluoro-N-methylnon-8-en-2-amine.

Molecular Properties

Compound Name1,1,1-trifluoro-N-methylnon-8-en-2-amine
PubChem CID107011900
Molecular FormulaC10H18F3N
Molecular Weight209.25 g/mol
Exact Mass209.14
IUPAC Name1,1,1-trifluoro-N-methylnon-8-en-2-amine
SMILESC=CCCCCCC(NC)C(F)(F)F
InChIInChI=1S/C10H18F3N/c1-3-4-5-6-7-8-9(14-2)10(11,12)13/h3,9,14H,1,4-8H2,2H3
InChIKeyPNHBNHOHWIKMMO-UHFFFAOYSA-N
XLogP3.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

25-methylhexacos-1-ene
CID 141407501
26-methylheptacos-1-ene
CID 154926473
N-methyloct-7-en-2-amine
CID 64502847
N-methyl-1-(2,2,2-trifluoroethoxy)non-8-en-2-amine
CID 107009840
1,1,1-trifluorooct-7-en-2-ol
CID 54303988
N-methylpentadec-1-en-8-amine
CID 107011425
3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine
CID 79068358
14,14,15,15,15-pentafluoro-8-methylpentadec-1-ene
CID 20579544
12,12,13,13,13-pentafluoro-8-methyltridec-1-ene
CID 20579541
15,16,16-trimethylheptadec-1-ene
CID 174505406
heptacosa-1,26-diene
CID 58905535
heptadeca-1,16-diene
CID 6429392

Frequently Asked Questions

What is the IUPAC name of 1,1,1-trifluoro-N-methylnon-8-en-2-amine?
The IUPAC name of 1,1,1-trifluoro-N-methylnon-8-en-2-amine (CID 107011900) is 1,1,1-trifluoro-N-methylnon-8-en-2-amine.
What is the SMILES notation for 1,1,1-trifluoro-N-methylnon-8-en-2-amine?
The canonical SMILES for 1,1,1-trifluoro-N-methylnon-8-en-2-amine is C=CCCCCCC(NC)C(F)(F)F.
What is the InChIKey of 1,1,1-trifluoro-N-methylnon-8-en-2-amine?
The InChIKey is PNHBNHOHWIKMMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3N/c1-3-4-5-6-7-8-9(14-2)10(11,12)13/h3,9,14H,1,4-8H2,2H3.
What are the key properties of 1,1,1-trifluoro-N-methylnon-8-en-2-amine?
1,1,1-trifluoro-N-methylnon-8-en-2-amine has a molecular weight of 209.25 g/mol, XLogP of 3.27, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1-trifluoro-N-methylnon-8-en-2-amine is sourced from PubChem (CID 107011900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).