N-(8-methyl-3-propylnon-4-en-2-yl)methanimine

C14H27N — CID 123669519

IUPACN-(8-methyl-3-propylnon-4-en-2-yl)methanimine
SMILESC=NC(C)C(C=CCCC(C)C)CCC
InChIInChI=1S/C14H27N/c1-6-9-14(13(4)15-5)11-8-7-10-12(2)3/h8,11-14H,5-7,9-10H2,1-4H3
InChIKeyAOHKPZYVVSKDNI-UHFFFAOYSA-N
MW209.38 g/mol
LogP4.48
Rot. Bonds8

About N-(8-methyl-3-propylnon-4-en-2-yl)methanimine

N-(8-methyl-3-propylnon-4-en-2-yl)methanimine (PubChem CID 123669519) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is N-(8-methyl-3-propylnon-4-en-2-yl)methanimine.

Molecular Properties

Compound NameN-(8-methyl-3-propylnon-4-en-2-yl)methanimine
PubChem CID123669519
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC NameN-(8-methyl-3-propylnon-4-en-2-yl)methanimine
SMILESC=NC(C)C(C=CCCC(C)C)CCC
InChIInChI=1S/C14H27N/c1-6-9-14(13(4)15-5)11-8-7-10-12(2)3/h8,11-14H,5-7,9-10H2,1-4H3
InChIKeyAOHKPZYVVSKDNI-UHFFFAOYSA-N
XLogP4.48
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-7-(3-methylbutyl)dodec-5-ene
CID 123813369
(6R)-6-methylnon-4-ene
CID 175484589
(2Z,5Z,8Z,11Z,14Z,17Z)-21-methyldocosa-2,5,8,11,14,17-hexaen-1-amine
CID 138745104
2-methylpentane
CID 7892
7-methyldeca-1,5-diene
CID 123987303
2,9-dimethylundec-5-ene
CID 123952487
2,8-dimethylnon-4-ene
CID 54058844
5-methylhex-1-en-1-amine
CID 87108942
azane;2-methylpentane
CID 87098569
ethane;2-methylpentane
CID 143713716
2-methylpentane;hydroiodide
CID 160726714
azane;2-methylpentane
CID 18347292

Frequently Asked Questions

What is the IUPAC name of N-(8-methyl-3-propylnon-4-en-2-yl)methanimine?
The IUPAC name of N-(8-methyl-3-propylnon-4-en-2-yl)methanimine (CID 123669519) is N-(8-methyl-3-propylnon-4-en-2-yl)methanimine.
What is the SMILES notation for N-(8-methyl-3-propylnon-4-en-2-yl)methanimine?
The canonical SMILES for N-(8-methyl-3-propylnon-4-en-2-yl)methanimine is C=NC(C)C(C=CCCC(C)C)CCC.
What is the InChIKey of N-(8-methyl-3-propylnon-4-en-2-yl)methanimine?
The InChIKey is AOHKPZYVVSKDNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-6-9-14(13(4)15-5)11-8-7-10-12(2)3/h8,11-14H,5-7,9-10H2,1-4H3.
What are the key properties of N-(8-methyl-3-propylnon-4-en-2-yl)methanimine?
N-(8-methyl-3-propylnon-4-en-2-yl)methanimine has a molecular weight of 209.38 g/mol, XLogP of 4.48, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methyl-3-propylnon-4-en-2-yl)methanimine is sourced from PubChem (CID 123669519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).