2,8-dimethyl-2-octoxynonan-4-amine

C19H41NO — CID 167249393

IUPAC2,8-dimethyl-2-octoxynonan-4-amine
SMILESCCCCCCCCOC(C)(C)CC(N)CCCC(C)C
InChIInChI=1S/C19H41NO/c1-6-7-8-9-10-11-15-21-19(4,5)16-18(20)14-12-13-17(2)3/h17-18H,6-16,20H2,1-5H3
InChIKeyGCLHJQVZKSOCTE-UHFFFAOYSA-N
MW299.54 g/mol
LogP5.69
Rot. Bonds14

About 2,8-dimethyl-2-octoxynonan-4-amine

2,8-dimethyl-2-octoxynonan-4-amine (PubChem CID 167249393) has the molecular formula C19H41NO and a molecular weight of 299.54 g/mol. Its IUPAC name is 2,8-dimethyl-2-octoxynonan-4-amine.

Molecular Properties

Compound Name2,8-dimethyl-2-octoxynonan-4-amine
PubChem CID167249393
Molecular FormulaC19H41NO
Molecular Weight299.54 g/mol
Exact Mass299.32
IUPAC Name2,8-dimethyl-2-octoxynonan-4-amine
SMILESCCCCCCCCOC(C)(C)CC(N)CCCC(C)C
InChIInChI=1S/C19H41NO/c1-6-7-8-9-10-11-15-21-19(4,5)16-18(20)14-12-13-17(2)3/h17-18H,6-16,20H2,1-5H3
InChIKeyGCLHJQVZKSOCTE-UHFFFAOYSA-N
XLogP5.69
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.54
LogP ≤ 55.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(2-methylbutan-2-yloxy)tetradecane
CID 86191698
2-dodecoxy-2-methyltetradecane
CID 158074564
2-methoxy-2,7-dimethyloctan-4-amine
CID 103025052
1-(2,3-dimethylbutan-2-yloxy)decane
CID 172756117
2-methyldecane
CID 23415
2-methyltetratriacontane
CID 14275207
2-methylpentaoctacontane
CID 90745672
2-methyloctacosane
CID 519147
16-methylheptadecyl (2S)-2-hexyldecanoate
CID 99121761
7-methyloctyl 2-heptyl-9-methyldecanoate
CID 140636835
hydroxylamine;2-methylnonadecane
CID 87902402
2,2-dimethylpropane;ethane;2-methylheptane
CID 143493212

Frequently Asked Questions

What is the IUPAC name of 2,8-dimethyl-2-octoxynonan-4-amine?
The IUPAC name of 2,8-dimethyl-2-octoxynonan-4-amine (CID 167249393) is 2,8-dimethyl-2-octoxynonan-4-amine.
What is the SMILES notation for 2,8-dimethyl-2-octoxynonan-4-amine?
The canonical SMILES for 2,8-dimethyl-2-octoxynonan-4-amine is CCCCCCCCOC(C)(C)CC(N)CCCC(C)C.
What is the InChIKey of 2,8-dimethyl-2-octoxynonan-4-amine?
The InChIKey is GCLHJQVZKSOCTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H41NO/c1-6-7-8-9-10-11-15-21-19(4,5)16-18(20)14-12-13-17(2)3/h17-18H,6-16,20H2,1-5H3.
What are the key properties of 2,8-dimethyl-2-octoxynonan-4-amine?
2,8-dimethyl-2-octoxynonan-4-amine has a molecular weight of 299.54 g/mol, XLogP of 5.69, 14 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-dimethyl-2-octoxynonan-4-amine is sourced from PubChem (CID 167249393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).