10-amino-4-methyldec-6-en-3-ol

C11H23NO — CID 91598548

IUPAC10-amino-4-methyldec-6-en-3-ol
SMILESCCC(O)C(C)CC=CCCCN
InChIInChI=1S/C11H23NO/c1-3-11(13)10(2)8-6-4-5-7-9-12/h4,6,10-11,13H,3,5,7-9,12H2,1-2H3
InChIKeyPRZXXTJCZAVXMV-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.08
Rot. Bonds7

About 10-amino-4-methyldec-6-en-3-ol

10-amino-4-methyldec-6-en-3-ol (PubChem CID 91598548) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 10-amino-4-methyldec-6-en-3-ol.

Molecular Properties

Compound Name10-amino-4-methyldec-6-en-3-ol
PubChem CID91598548
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name10-amino-4-methyldec-6-en-3-ol
SMILESCCC(O)C(C)CC=CCCCN
InChIInChI=1S/C11H23NO/c1-3-11(13)10(2)8-6-4-5-7-9-12/h4,6,10-11,13H,3,5,7-9,12H2,1-2H3
InChIKeyPRZXXTJCZAVXMV-UHFFFAOYSA-N
XLogP2.08
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 10-amino-4-methyldec-6-en-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 10-amino-4-methyldec-6-en-3-ol?
The IUPAC name of 10-amino-4-methyldec-6-en-3-ol (CID 91598548) is 10-amino-4-methyldec-6-en-3-ol.
What is the SMILES notation for 10-amino-4-methyldec-6-en-3-ol?
The canonical SMILES for 10-amino-4-methyldec-6-en-3-ol is CCC(O)C(C)CC=CCCCN.
What is the InChIKey of 10-amino-4-methyldec-6-en-3-ol?
The InChIKey is PRZXXTJCZAVXMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-11(13)10(2)8-6-4-5-7-9-12/h4,6,10-11,13H,3,5,7-9,12H2,1-2H3.
What are the key properties of 10-amino-4-methyldec-6-en-3-ol?
10-amino-4-methyldec-6-en-3-ol has a molecular weight of 185.31 g/mol, XLogP of 2.08, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-amino-4-methyldec-6-en-3-ol is sourced from PubChem (CID 91598548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).