6-methyl-7-methylidenecycloundecan-1-imine

C13H23N — CID 123369621

IUPAC6-methyl-7-methylidenecycloundecan-1-imine
SMILES[H]/N=C1/CCCCC(=C)C(C)CCCC1
InChIInChI=1S/C13H23N/c1-11-7-3-5-9-13(14)10-6-4-8-12(11)2/h12,14H,1,3-10H2,2H3/b14-13-
InChIKeyYWSIPULNBGYATQ-YPKPFQOOSA-N
MW193.33 g/mol
LogP4.33
Rot. Bonds

About 6-methyl-7-methylidenecycloundecan-1-imine

6-methyl-7-methylidenecycloundecan-1-imine (PubChem CID 123369621) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is 6-methyl-7-methylidenecycloundecan-1-imine.

Molecular Properties

Compound Name6-methyl-7-methylidenecycloundecan-1-imine
PubChem CID123369621
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name6-methyl-7-methylidenecycloundecan-1-imine
SMILES[H]/N=C1/CCCCC(=C)C(C)CCCC1
InChIInChI=1S/C13H23N/c1-11-7-3-5-9-13(14)10-6-4-8-12(11)2/h12,14H,1,3-10H2,2H3/b14-13-
InChIKeyYWSIPULNBGYATQ-YPKPFQOOSA-N
XLogP4.33
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
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': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

5-Fluoro-3-methyl-2-methylidenecycloheptan-1-imine
CID 124032830
(3R)-5-ethenyl-2-fluoro-3-methyl-7-methylidenenon-8-en-4-imine
CID 139423709
(10S)-10-fluoro-2-methyl-5-methylideneundecane-3,6-diimine
CID 155158155
10-Fluoro-2-methyl-4-methylideneundecane-3,6-diimine
CID 155158434
(3R,5S)-5-fluoro-6-(fluoromethyl)-3,7-dimethyloct-7-en-4-imine
CID 173772004
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
3-(2-Methylprop-2-enyl)-4-propyloctan-2-imine
CID 90894242
2,5-Dimethylhept-1-en-3-imine
CID 91222633
4-N-butan-2-yl-6,7-dimethyloct-7-ene-3,4-diimine
CID 91435545
3,7,8,10-Tetramethyldodec-9-en-4-imine
CID 91500026

Frequently Asked Questions

What is the IUPAC name of 6-methyl-7-methylidenecycloundecan-1-imine?
The IUPAC name of 6-methyl-7-methylidenecycloundecan-1-imine (CID 123369621) is 6-methyl-7-methylidenecycloundecan-1-imine.
What is the SMILES notation for 6-methyl-7-methylidenecycloundecan-1-imine?
The canonical SMILES for 6-methyl-7-methylidenecycloundecan-1-imine is [H]/N=C1/CCCCC(=C)C(C)CCCC1.
What is the InChIKey of 6-methyl-7-methylidenecycloundecan-1-imine?
The InChIKey is YWSIPULNBGYATQ-YPKPFQOOSA-N. The full InChI is InChI=1S/C13H23N/c1-11-7-3-5-9-13(14)10-6-4-8-12(11)2/h12,14H,1,3-10H2,2H3/b14-13-.
What are the key properties of 6-methyl-7-methylidenecycloundecan-1-imine?
6-methyl-7-methylidenecycloundecan-1-imine has a molecular weight of 193.33 g/mol, XLogP of 4.33, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-7-methylidenecycloundecan-1-imine is sourced from PubChem (CID 123369621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).