7,7,9-trimethyl-3-methylidenedecan-2-amine

C14H29N — CID 123470247

IUPAC7,7,9-trimethyl-3-methylidenedecan-2-amine
SMILESC=C(CCCC(C)(C)CC(C)C)C(C)N
InChIInChI=1S/C14H29N/c1-11(2)10-14(5,6)9-7-8-12(3)13(4)15/h11,13H,3,7-10,15H2,1-2,4-6H3
InChIKeyZWFJVAZLFLNBSF-UHFFFAOYSA-N
MW211.39 g/mol
LogP4.13
Rot. Bonds7

About 7,7,9-trimethyl-3-methylidenedecan-2-amine

7,7,9-trimethyl-3-methylidenedecan-2-amine (PubChem CID 123470247) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 7,7,9-trimethyl-3-methylidenedecan-2-amine.

Molecular Properties

Compound Name7,7,9-trimethyl-3-methylidenedecan-2-amine
PubChem CID123470247
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name7,7,9-trimethyl-3-methylidenedecan-2-amine
SMILESC=C(CCCC(C)(C)CC(C)C)C(C)N
InChIInChI=1S/C14H29N/c1-11(2)10-14(5,6)9-7-8-12(3)13(4)15/h11,13H,3,7-10,15H2,1-2,4-6H3
InChIKeyZWFJVAZLFLNBSF-UHFFFAOYSA-N
XLogP4.13
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3,7-Dimethyloct-7-enylazanium
CID 72200507
3,7-Dimethyloct-7-en-1-amine
CID 53497564
Tetravinylpentylamine
CID 172914372
(3R)-2-methyl-6-(trifluoromethyl)oct-1-en-3-amine
CID 89073715
2-Methyl-6-(trifluoromethyl)oct-1-en-3-amine
CID 89154096
(2S,3R)-3-methyl-3-[(2S)-pentan-2-yl]-8-(trifluoromethyl)non-8-en-2-amine
CID 163840784
2,5-Dimethyl-5-(trifluoromethyl)hept-1-en-3-amine
CID 167281608
(5S)-5-(difluoromethyl)-2,5-dimethyloct-1-en-3-amine
CID 167281696
6-Fluoro-2,6-dimethylhept-1-en-3-amine
CID 167281896
8-Nonen-4-amine, 2-methyl-
CID 11829678
(3R)-3,7-dimethyl-6-methylideneoctan-1-amine
CID 90715518
(1R)-1-cyclohexyl-2,2-dimethylbut-3-en-1-amine
CID 134994238

Frequently Asked Questions

What is the IUPAC name of 7,7,9-trimethyl-3-methylidenedecan-2-amine?
The IUPAC name of 7,7,9-trimethyl-3-methylidenedecan-2-amine (CID 123470247) is 7,7,9-trimethyl-3-methylidenedecan-2-amine.
What is the SMILES notation for 7,7,9-trimethyl-3-methylidenedecan-2-amine?
The canonical SMILES for 7,7,9-trimethyl-3-methylidenedecan-2-amine is C=C(CCCC(C)(C)CC(C)C)C(C)N.
What is the InChIKey of 7,7,9-trimethyl-3-methylidenedecan-2-amine?
The InChIKey is ZWFJVAZLFLNBSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-11(2)10-14(5,6)9-7-8-12(3)13(4)15/h11,13H,3,7-10,15H2,1-2,4-6H3.
What are the key properties of 7,7,9-trimethyl-3-methylidenedecan-2-amine?
7,7,9-trimethyl-3-methylidenedecan-2-amine has a molecular weight of 211.39 g/mol, XLogP of 4.13, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7,9-trimethyl-3-methylidenedecan-2-amine is sourced from PubChem (CID 123470247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).