7-methyldec-5-en-1-imine

C11H21N — CID 123926616

IUPAC7-methyldec-5-en-1-imine
SMILES[H]/N=C/CCCC=CC(C)CCC
InChIInChI=1S/C11H21N/c1-3-8-11(2)9-6-4-5-7-10-12/h6,9-12H,3-5,7-8H2,1-2H3/b9-6?,12-10+
InChIKeyRKKVXKWTWGFOKA-GEKSPHCTSA-N
MW167.30 g/mol
LogP3.80
Rot. Bonds7

About 7-methyldec-5-en-1-imine

7-methyldec-5-en-1-imine (PubChem CID 123926616) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 7-methyldec-5-en-1-imine.

Molecular Properties

Compound Name7-methyldec-5-en-1-imine
PubChem CID123926616
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name7-methyldec-5-en-1-imine
SMILES[H]/N=C/CCCC=CC(C)CCC
InChIInChI=1S/C11H21N/c1-3-8-11(2)9-6-4-5-7-10-12/h6,9-12H,3-5,7-8H2,1-2H3/b9-6?,12-10+
InChIKeyRKKVXKWTWGFOKA-GEKSPHCTSA-N
XLogP3.80
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 53.80
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

(Z)-6-fluoro-2-methylhept-3-en-1-imine
CID 88562245
(4-Fluoro-5-methylcyclohexa-2,4-dien-1-yl)methanimine
CID 163700177
Oct-3-en-1-imine
CID 53787635
2-Methylpent-3-en-1-imine
CID 56620219
2-Methyldec-3-en-1-imine
CID 57110449
2-Methylhex-3-en-1-imine
CID 57195916
1-(Cyclohex-3-en-1-yl)methanimine
CID 57306453
3-Propan-2-ylpent-4-en-1-imine
CID 58352436
(Z)-5-methyl-3-propan-2-ylhex-2-ene-1,4-diimine
CID 88583469
(6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine
CID 88960923
(E)-4-ethenyl-N-methylhept-2-en-1-imine
CID 89064411
2-Cyclohex-2-en-1-ylethanimine
CID 89097602

Frequently Asked Questions

What is the IUPAC name of 7-methyldec-5-en-1-imine?
The IUPAC name of 7-methyldec-5-en-1-imine (CID 123926616) is 7-methyldec-5-en-1-imine.
What is the SMILES notation for 7-methyldec-5-en-1-imine?
The canonical SMILES for 7-methyldec-5-en-1-imine is [H]/N=C/CCCC=CC(C)CCC.
What is the InChIKey of 7-methyldec-5-en-1-imine?
The InChIKey is RKKVXKWTWGFOKA-GEKSPHCTSA-N. The full InChI is InChI=1S/C11H21N/c1-3-8-11(2)9-6-4-5-7-10-12/h6,9-12H,3-5,7-8H2,1-2H3/b9-6?,12-10+.
What are the key properties of 7-methyldec-5-en-1-imine?
7-methyldec-5-en-1-imine has a molecular weight of 167.30 g/mol, XLogP of 3.80, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyldec-5-en-1-imine is sourced from PubChem (CID 123926616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).