1-cyclopropyl-8-methylnon-7-en-2-imine

C13H23N — CID 91585531

IUPAC1-cyclopropyl-8-methylnon-7-en-2-imine
SMILES[H]/N=C(\CCCCC=C(C)C)CC1CC1
InChIInChI=1S/C13H23N/c1-11(2)6-4-3-5-7-13(14)10-12-8-9-12/h6,12,14H,3-5,7-10H2,1-2H3/b14-13+
InChIKeyAAPZOHRVNYCFOS-BUHFOSPRSA-N
MW193.33 g/mol
LogP4.33
Rot. Bonds7

About 1-cyclopropyl-8-methylnon-7-en-2-imine

1-cyclopropyl-8-methylnon-7-en-2-imine (PubChem CID 91585531) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is 1-cyclopropyl-8-methylnon-7-en-2-imine.

Molecular Properties

Compound Name1-cyclopropyl-8-methylnon-7-en-2-imine
PubChem CID91585531
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name1-cyclopropyl-8-methylnon-7-en-2-imine
SMILES[H]/N=C(\CCCCC=C(C)C)CC1CC1
InChIInChI=1S/C13H23N/c1-11(2)6-4-3-5-7-13(14)10-12-8-9-12/h6,12,14H,3-5,7-10H2,1-2H3/b14-13+
InChIKeyAAPZOHRVNYCFOS-BUHFOSPRSA-N
XLogP4.33
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-Ethylidene-6-fluoro-6-methyl-5-prop-1-en-2-yloctan-2-imine
CID 91340707
(E)-6-fluoro-3-(2-methylpropyl)-5-propylnon-6-en-2-imine
CID 163433107
2-Ethyl-4-methylcyclohex-2-en-1-imine
CID 57087859
2-Heptan-2-ylcyclohexa-2,5-diene-1,4-diimine
CID 69973378
1-(2,5-Dimethylcyclohexa-1,3-dien-1-yl)butan-1-imine
CID 88907679
4-(2-Ethylbut-1-enyl)cyclohexan-1-imine
CID 89040033
(2S)-1-cyclohex-3-en-1-yl-2-methylbutan-1-imine
CID 89058429
4-(2-Methyl-5-prop-1-en-2-ylcyclopenten-1-yl)butan-2-imine
CID 89084617
(E)-5-ethyl-6-methylundec-6-en-4-imine
CID 89117109
(E)-2,6-dimethyloct-6-en-3-imine
CID 89688388
(Z)-4,5-dimethylhept-5-en-2-imine
CID 89961034
3,4-Dimethylnonadec-4-en-2-imine
CID 90701374

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-8-methylnon-7-en-2-imine?
The IUPAC name of 1-cyclopropyl-8-methylnon-7-en-2-imine (CID 91585531) is 1-cyclopropyl-8-methylnon-7-en-2-imine.
What is the SMILES notation for 1-cyclopropyl-8-methylnon-7-en-2-imine?
The canonical SMILES for 1-cyclopropyl-8-methylnon-7-en-2-imine is [H]/N=C(\CCCCC=C(C)C)CC1CC1.
What is the InChIKey of 1-cyclopropyl-8-methylnon-7-en-2-imine?
The InChIKey is AAPZOHRVNYCFOS-BUHFOSPRSA-N. The full InChI is InChI=1S/C13H23N/c1-11(2)6-4-3-5-7-13(14)10-12-8-9-12/h6,12,14H,3-5,7-10H2,1-2H3/b14-13+.
What are the key properties of 1-cyclopropyl-8-methylnon-7-en-2-imine?
1-cyclopropyl-8-methylnon-7-en-2-imine has a molecular weight of 193.33 g/mol, XLogP of 4.33, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-8-methylnon-7-en-2-imine is sourced from PubChem (CID 91585531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).