N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine

C18H35N — CID 134313970

IUPACN-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine
SMILESC=N/C=C(/CCCCC(C)C)C(CC)CCC(C)C
InChIInChI=1S/C18H35N/c1-7-17(13-12-16(4)5)18(14-19-6)11-9-8-10-15(2)3/h14-17H,6-13H2,1-5H3/b18-14-
InChIKeyUPZBEIXFUTUQAZ-JXAWBTAJSA-N
MW265.49 g/mol
LogP6.25
Rot. Bonds11

About N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine

N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine (PubChem CID 134313970) has the molecular formula C18H35N and a molecular weight of 265.49 g/mol. Its IUPAC name is N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine.

Molecular Properties

Compound NameN-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine
PubChem CID134313970
Molecular FormulaC18H35N
Molecular Weight265.49 g/mol
Exact Mass265.28
IUPAC NameN-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine
SMILESC=N/C=C(/CCCCC(C)C)C(CC)CCC(C)C
InChIInChI=1S/C18H35N/c1-7-17(13-12-16(4)5)18(14-19-6)11-9-8-10-15(2)3/h14-17H,6-13H2,1-5H3/b18-14-
InChIKeyUPZBEIXFUTUQAZ-JXAWBTAJSA-N
XLogP6.25
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.49
LogP ≤ 56.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine
CID 118055411
N-(3-ethyl-2-methyloct-1-enyl)prop-1-en-1-imine
CID 123267671
(4,8-Diethyl-2,11-dimethyldodec-1-enyl)-methyl-methylideneazanium
CID 123634732
N-(3-butyl-2-methyloct-1-enyl)methanimine
CID 123742477
N-[(E)-2-ethenyl-3-pentylnon-1-enyl]prop-2-en-1-imine
CID 126626428
N-[(E)-2-ethenyl-3-hexylnon-1-enyl]propan-1-imine
CID 126626483
N-[(E)-2-ethenyl-3-hexylnon-1-enyl]prop-2-en-1-imine
CID 126626585
(2Z)-2-[(ethylideneamino)methylidene]-N-methyl-3-pentyldecan-1-imine
CID 130314514
N-[(E)-2,4-dimethyl-3-methylideneoct-1-enyl]methanimine
CID 131971023
N-[(E)-2-ethenyl-3-hexyldec-1-enyl]prop-2-en-1-imine
CID 134545997
N-[(E)-2-ethenyl-3-pentylnon-1-enyl]propan-1-imine
CID 138705440
N-[(E)-2-ethenyl-3-pentyloct-1-enyl]propan-1-imine
CID 139315481

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine?
The IUPAC name of N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine (CID 134313970) is N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine.
What is the SMILES notation for N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine?
The canonical SMILES for N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine is C=N/C=C(/CCCCC(C)C)C(CC)CCC(C)C.
What is the InChIKey of N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine?
The InChIKey is UPZBEIXFUTUQAZ-JXAWBTAJSA-N. The full InChI is InChI=1S/C18H35N/c1-7-17(13-12-16(4)5)18(14-19-6)11-9-8-10-15(2)3/h14-17H,6-13H2,1-5H3/b18-14-.
What are the key properties of N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine?
N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine has a molecular weight of 265.49 g/mol, XLogP of 6.25, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-7-methyl-2-(6-methylheptan-3-yl)oct-1-enyl]methanimine is sourced from PubChem (CID 134313970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).