(E)-5-methyldec-2-en-4-imine

C11H21N — CID 123985008

IUPAC(E)-5-methyldec-2-en-4-imine
SMILES[H]/N=C(\C=C\C)C(C)CCCCC
InChIInChI=1S/C11H21N/c1-4-6-7-9-10(3)11(12)8-5-2/h5,8,10,12H,4,6-7,9H2,1-3H3/b8-5+,12-11+
InChIKeyPZCXQNONWKWYQS-CQYWEGEGSA-N
MW167.30 g/mol
LogP3.80
Rot. Bonds6

About (E)-5-methyldec-2-en-4-imine

(E)-5-methyldec-2-en-4-imine (PubChem CID 123985008) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is (E)-5-methyldec-2-en-4-imine.

Molecular Properties

Compound Name(E)-5-methyldec-2-en-4-imine
PubChem CID123985008
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name(E)-5-methyldec-2-en-4-imine
SMILES[H]/N=C(\C=C\C)C(C)CCCCC
InChIInChI=1S/C11H21N/c1-4-6-7-9-10(3)11(12)8-5-2/h5,8,10,12H,4,6-7,9H2,1-3H3/b8-5+,12-11+
InChIKeyPZCXQNONWKWYQS-CQYWEGEGSA-N
XLogP3.80
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
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'}

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Related Compounds

3-Ethylidene-6-fluoro-6-methyl-5-prop-1-en-2-yloctan-2-imine
CID 91340707
(6Z)-10-(4-fluoro-6-methylcyclohexa-1,3-dien-1-yl)undeca-1,6-dien-5-imine
CID 153399956
(E)-6-fluoro-3-(2-methylpropyl)-5-propylnon-6-en-2-imine
CID 163433107
1-Cyclohexyl-imino-2-butene
CID 129765474
3,5-Dimethylcyclohex-2-en-1-imine
CID 12562472
2,6-Di(propan-2-yl)cyclohexa-2,4-dien-1-imine
CID 17962987
19,21-Dimethyl-19,21-bis(2-methylpropyl)nonatriaconta-9,30-dien-20-imine
CID 54130774
2-Ethyl-4-methylcyclohex-2-en-1-imine
CID 57087859
2-Cyclohex-2-en-1-yl-2,4-dimethylhexan-3-imine
CID 58555275
2-Butan-2-ylcyclohexa-2,5-diene-1,4-diimine
CID 69931975
2-Heptan-2-ylcyclohexa-2,5-diene-1,4-diimine
CID 69973378
6-Methylcyclohex-2-en-1-imine
CID 86188349

Frequently Asked Questions

What is the IUPAC name of (E)-5-methyldec-2-en-4-imine?
The IUPAC name of (E)-5-methyldec-2-en-4-imine (CID 123985008) is (E)-5-methyldec-2-en-4-imine.
What is the SMILES notation for (E)-5-methyldec-2-en-4-imine?
The canonical SMILES for (E)-5-methyldec-2-en-4-imine is [H]/N=C(\C=C\C)C(C)CCCCC.
What is the InChIKey of (E)-5-methyldec-2-en-4-imine?
The InChIKey is PZCXQNONWKWYQS-CQYWEGEGSA-N. The full InChI is InChI=1S/C11H21N/c1-4-6-7-9-10(3)11(12)8-5-2/h5,8,10,12H,4,6-7,9H2,1-3H3/b8-5+,12-11+.
What are the key properties of (E)-5-methyldec-2-en-4-imine?
(E)-5-methyldec-2-en-4-imine has a molecular weight of 167.30 g/mol, XLogP of 3.80, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-methyldec-2-en-4-imine is sourced from PubChem (CID 123985008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).