3-methyl-3-(methylamino)nonan-1-ol

C11H25NO — CID 65235279

IUPAC3-methyl-3-(methylamino)nonan-1-ol
SMILESCCCCCCC(C)(CCO)NC
InChIInChI=1S/C11H25NO/c1-4-5-6-7-8-11(2,12-3)9-10-13/h12-13H,4-10H2,1-3H3
InChIKeyBTWNILDGTQAWEA-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.32
Rot. Bonds8

About 3-methyl-3-(methylamino)nonan-1-ol

3-methyl-3-(methylamino)nonan-1-ol (PubChem CID 65235279) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 3-methyl-3-(methylamino)nonan-1-ol.

Molecular Properties

Compound Name3-methyl-3-(methylamino)nonan-1-ol
PubChem CID65235279
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name3-methyl-3-(methylamino)nonan-1-ol
SMILESCCCCCCC(C)(CCO)NC
InChIInChI=1S/C11H25NO/c1-4-5-6-7-8-11(2,12-3)9-10-13/h12-13H,4-10H2,1-3H3
InChIKeyBTWNILDGTQAWEA-UHFFFAOYSA-N
XLogP2.32
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-methyl-3-(octylamino)pentane-1,5-diol
CID 54557477
3,3-dimethyloctan-1-ol
CID 18704344
7,7-dimethyldocosan-1-ol
CID 150860437
3-methyl-3-(methylamino)octanoic acid
CID 80558530
3,3-difluoro-4-(5-methylundecan-5-ylamino)butan-1-ol
CID 155451069
3-heptadecyl-3-(2-hydroxyethyl)pentane-1,5-diol
CID 87979521
3,3-dioctadecylpentane-1,5-diol
CID 59698466
2,2-dimethyldecan-1-ol
CID 520069
decan-1-ol;8,8-dimethylundecan-1-ol
CID 162145912
6-butoxy-2-methyl-2-(methylamino)hexan-1-ol
CID 64806053
2-methyl-2-(methylamino)pentadecanoic acid
CID 90221334
2-methyl-2-(methylamino)nonanoic acid
CID 43753674

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-(methylamino)nonan-1-ol?
The IUPAC name of 3-methyl-3-(methylamino)nonan-1-ol (CID 65235279) is 3-methyl-3-(methylamino)nonan-1-ol.
What is the SMILES notation for 3-methyl-3-(methylamino)nonan-1-ol?
The canonical SMILES for 3-methyl-3-(methylamino)nonan-1-ol is CCCCCCC(C)(CCO)NC.
What is the InChIKey of 3-methyl-3-(methylamino)nonan-1-ol?
The InChIKey is BTWNILDGTQAWEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-4-5-6-7-8-11(2,12-3)9-10-13/h12-13H,4-10H2,1-3H3.
What are the key properties of 3-methyl-3-(methylamino)nonan-1-ol?
3-methyl-3-(methylamino)nonan-1-ol has a molecular weight of 187.33 g/mol, XLogP of 2.32, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-(methylamino)nonan-1-ol is sourced from PubChem (CID 65235279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).