9-amino-3-methylnon-6-en-2-ol

C10H21NO — CID 91261057

IUPAC9-amino-3-methylnon-6-en-2-ol
SMILESCC(O)C(C)CCC=CCCN
InChIInChI=1S/C10H21NO/c1-9(10(2)12)7-5-3-4-6-8-11/h3-4,9-10,12H,5-8,11H2,1-2H3
InChIKeyJYFWGKKYILBCOJ-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.69
Rot. Bonds6

About 9-amino-3-methylnon-6-en-2-ol

9-amino-3-methylnon-6-en-2-ol (PubChem CID 91261057) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 9-amino-3-methylnon-6-en-2-ol.

Molecular Properties

Compound Name9-amino-3-methylnon-6-en-2-ol
PubChem CID91261057
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name9-amino-3-methylnon-6-en-2-ol
SMILESCC(O)C(C)CCC=CCCN
InChIInChI=1S/C10H21NO/c1-9(10(2)12)7-5-3-4-6-8-11/h3-4,9-10,12H,5-8,11H2,1-2H3
InChIKeyJYFWGKKYILBCOJ-UHFFFAOYSA-N
XLogP1.69
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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(7-Methyl-9-hydroxy-2-nonenyl)amine
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(4R,5R,E)-1-amino-4-ethyl-8-methyldec-8-en-5-ol
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3-(4-Aminobut-1-enyl)pentane-1,5-diol
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6-(3-Amino-2-methylpropyl)cyclohex-3-en-1-ol
CID 68186766
1-(Cyclohex-3-en-1-yl)-2-(methylamino)ethan-1-ol
CID 84013562
1-Amino-2-propylpent-4-en-1-ol
CID 88029329
(E,2S,3R)-9-amino-3-methylnon-6-en-2-ol
CID 88887574
(E)-3-amino-4-ethyldec-5-en-1-ol
CID 89126658
5-(Aminomethyl)oct-7-en-2-ol
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CID 89473215

Frequently Asked Questions

What is the IUPAC name of 9-amino-3-methylnon-6-en-2-ol?
The IUPAC name of 9-amino-3-methylnon-6-en-2-ol (CID 91261057) is 9-amino-3-methylnon-6-en-2-ol.
What is the SMILES notation for 9-amino-3-methylnon-6-en-2-ol?
The canonical SMILES for 9-amino-3-methylnon-6-en-2-ol is CC(O)C(C)CCC=CCCN.
What is the InChIKey of 9-amino-3-methylnon-6-en-2-ol?
The InChIKey is JYFWGKKYILBCOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-9(10(2)12)7-5-3-4-6-8-11/h3-4,9-10,12H,5-8,11H2,1-2H3.
What are the key properties of 9-amino-3-methylnon-6-en-2-ol?
9-amino-3-methylnon-6-en-2-ol has a molecular weight of 171.28 g/mol, XLogP of 1.69, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-amino-3-methylnon-6-en-2-ol is sourced from PubChem (CID 91261057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).