2-methyldec-2-en-4-amine

C11H23N — CID 59335300

IUPAC2-methyldec-2-en-4-amine
SMILESCCCCCCC(N)C=C(C)C
InChIInChI=1S/C11H23N/c1-4-5-6-7-8-11(12)9-10(2)3/h9,11H,4-8,12H2,1-3H3
InChIKeyQUOSACFSOCNYHO-UHFFFAOYSA-N
MW169.31 g/mol
LogP3.25
Rot. Bonds6

About 2-methyldec-2-en-4-amine

2-methyldec-2-en-4-amine (PubChem CID 59335300) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 2-methyldec-2-en-4-amine.

Molecular Properties

Compound Name2-methyldec-2-en-4-amine
PubChem CID59335300
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name2-methyldec-2-en-4-amine
SMILESCCCCCCC(N)C=C(C)C
InChIInChI=1S/C11H23N/c1-4-5-6-7-8-11(12)9-10(2)3/h9,11H,4-8,12H2,1-3H3
InChIKeyQUOSACFSOCNYHO-UHFFFAOYSA-N
XLogP3.25
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 53.25
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

2,4-dimethyldec-2-ene
CID 522542
2-aminooctanal
CID 54076326
5-methyl-1-propoxyhex-4-en-3-amine
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pentacosan-7-amine
CID 88938409
nonapentacontan-30-amine
CID 118952570
1-aminooctadecane-1,2-diol
CID 54498715
1-aminohexadecan-1-ol
CID 21475561
(2S,3S)-2-aminoundecan-3-ol
CID 132514193
13-aminoheptacosan-12-ol
CID 118194809
2-aminotetradecan-3-ol
CID 10198494
acetic acid;heptatriacontan-19-amine
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hexatriacontane-1,1-diamine
CID 21495844

Frequently Asked Questions

What is the IUPAC name of 2-methyldec-2-en-4-amine?
The IUPAC name of 2-methyldec-2-en-4-amine (CID 59335300) is 2-methyldec-2-en-4-amine.
What is the SMILES notation for 2-methyldec-2-en-4-amine?
The canonical SMILES for 2-methyldec-2-en-4-amine is CCCCCCC(N)C=C(C)C.
What is the InChIKey of 2-methyldec-2-en-4-amine?
The InChIKey is QUOSACFSOCNYHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-4-5-6-7-8-11(12)9-10(2)3/h9,11H,4-8,12H2,1-3H3.
What are the key properties of 2-methyldec-2-en-4-amine?
2-methyldec-2-en-4-amine has a molecular weight of 169.31 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyldec-2-en-4-amine is sourced from PubChem (CID 59335300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).