6-methyl-4-methylidenehept-2-en-1-imine

C9H15N — CID 91328344

IUPAC6-methyl-4-methylidenehept-2-en-1-imine
SMILES[H]/N=C/C=CC(=C)CC(C)C
InChIInChI=1S/C9H15N/c1-8(2)7-9(3)5-4-6-10/h4-6,8,10H,3,7H2,1-2H3/b5-4?,10-6+
InChIKeyZGLNIYPNUSZCKE-PFQJZCSNSA-N
MW137.23 g/mol
LogP2.79
Rot. Bonds4

About 6-methyl-4-methylidenehept-2-en-1-imine

6-methyl-4-methylidenehept-2-en-1-imine (PubChem CID 91328344) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 6-methyl-4-methylidenehept-2-en-1-imine.

Molecular Properties

Compound Name6-methyl-4-methylidenehept-2-en-1-imine
PubChem CID91328344
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name6-methyl-4-methylidenehept-2-en-1-imine
SMILES[H]/N=C/C=CC(=C)CC(C)C
InChIInChI=1S/C9H15N/c1-8(2)7-9(3)5-4-6-10/h4-6,8,10H,3,7H2,1-2H3/b5-4?,10-6+
InChIKeyZGLNIYPNUSZCKE-PFQJZCSNSA-N
XLogP2.79
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(4-Fluoro-5-methylcyclohexa-2,4-dien-1-yl)methanimine
CID 163700177
4-Methylnona-2,4,6,8-tetraen-1-imine
CID 91326389
4-Methylpenta-2,4-dienylideneazanium
CID 91576873
(2E,5E,8E,10E)-11-fluoro-3,4,6-trimethyldodeca-2,5,8,10-tetraen-1-imine
CID 143603539
(2Z,6E,8Z)-4,5-dimethylidene-6-(trifluoromethyl)deca-2,6,8-trien-1-imine
CID 143910763
(2E,4E,6Z)-4-fluoro-3-methylundeca-2,4,6-trien-1-imine
CID 176928626
(2E,4E)-3-methylhexa-2,4-dien-1-imine
CID 21721518
(2E)-3-propan-2-ylpenta-2,4-dien-1-imine
CID 58352423
3,7-Dimethylocta-2,4,6-trien-1-imine
CID 73829488
3-Methylhexa-2,4-dien-1-imine
CID 73829764
(4-Methylcyclohexa-2,4-dien-1-yl)methanimine
CID 88562250
(2Z,4Z)-3-methylhexa-2,4-dien-1-imine
CID 88581069

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-methylidenehept-2-en-1-imine?
The IUPAC name of 6-methyl-4-methylidenehept-2-en-1-imine (CID 91328344) is 6-methyl-4-methylidenehept-2-en-1-imine.
What is the SMILES notation for 6-methyl-4-methylidenehept-2-en-1-imine?
The canonical SMILES for 6-methyl-4-methylidenehept-2-en-1-imine is [H]/N=C/C=CC(=C)CC(C)C.
What is the InChIKey of 6-methyl-4-methylidenehept-2-en-1-imine?
The InChIKey is ZGLNIYPNUSZCKE-PFQJZCSNSA-N. The full InChI is InChI=1S/C9H15N/c1-8(2)7-9(3)5-4-6-10/h4-6,8,10H,3,7H2,1-2H3/b5-4?,10-6+.
What are the key properties of 6-methyl-4-methylidenehept-2-en-1-imine?
6-methyl-4-methylidenehept-2-en-1-imine has a molecular weight of 137.23 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-methylidenehept-2-en-1-imine is sourced from PubChem (CID 91328344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).