4-methyl-6-methyliminohex-4-en-1-ol

C8H15NO — CID 123229373

IUPAC4-methyl-6-methyliminohex-4-en-1-ol
SMILESC/N=C/C=C(C)CCCO
InChIInChI=1S/C8H15NO/c1-8(4-3-7-10)5-6-9-2/h5-6,10H,3-4,7H2,1-2H3/b8-5?,9-6+
InChIKeyKNAUGBABDBFJKB-QTQRZSEBSA-N
MW141.21 g/mol
LogP1.41
Rot. Bonds4

About 4-methyl-6-methyliminohex-4-en-1-ol

4-methyl-6-methyliminohex-4-en-1-ol (PubChem CID 123229373) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 4-methyl-6-methyliminohex-4-en-1-ol.

Molecular Properties

Compound Name4-methyl-6-methyliminohex-4-en-1-ol
PubChem CID123229373
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name4-methyl-6-methyliminohex-4-en-1-ol
SMILESC/N=C/C=C(C)CCCO
InChIInChI=1S/C8H15NO/c1-8(4-3-7-10)5-6-9-2/h5-6,10H,3-4,7H2,1-2H3/b8-5?,9-6+
InChIKeyKNAUGBABDBFJKB-QTQRZSEBSA-N
XLogP1.41
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-methyliminohex-4-en-1-ol?
The IUPAC name of 4-methyl-6-methyliminohex-4-en-1-ol (CID 123229373) is 4-methyl-6-methyliminohex-4-en-1-ol.
What is the SMILES notation for 4-methyl-6-methyliminohex-4-en-1-ol?
The canonical SMILES for 4-methyl-6-methyliminohex-4-en-1-ol is C/N=C/C=C(C)CCCO.
What is the InChIKey of 4-methyl-6-methyliminohex-4-en-1-ol?
The InChIKey is KNAUGBABDBFJKB-QTQRZSEBSA-N. The full InChI is InChI=1S/C8H15NO/c1-8(4-3-7-10)5-6-9-2/h5-6,10H,3-4,7H2,1-2H3/b8-5?,9-6+.
What are the key properties of 4-methyl-6-methyliminohex-4-en-1-ol?
4-methyl-6-methyliminohex-4-en-1-ol has a molecular weight of 141.21 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-methyliminohex-4-en-1-ol is sourced from PubChem (CID 123229373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).