4-methyl-3-propan-2-ylidenehexan-2-imine

C10H19N — CID 154973518

IUPAC4-methyl-3-propan-2-ylidenehexan-2-imine
SMILES[H]/N=C(\C)C(=C(C)C)C(C)CC
InChIInChI=1S/C10H19N/c1-6-8(4)10(7(2)3)9(5)11/h8,11H,6H2,1-5H3/b11-9+
InChIKeyISUJFSLHOGFPBF-PKNBQFBNSA-N
MW153.27 g/mol
LogP3.41
Rot. Bonds3

About 4-methyl-3-propan-2-ylidenehexan-2-imine

4-methyl-3-propan-2-ylidenehexan-2-imine (PubChem CID 154973518) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 4-methyl-3-propan-2-ylidenehexan-2-imine.

Molecular Properties

Compound Name4-methyl-3-propan-2-ylidenehexan-2-imine
PubChem CID154973518
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name4-methyl-3-propan-2-ylidenehexan-2-imine
SMILES[H]/N=C(\C)C(=C(C)C)C(C)CC
InChIInChI=1S/C10H19N/c1-6-8(4)10(7(2)3)9(5)11/h8,11H,6H2,1-5H3/b11-9+
InChIKeyISUJFSLHOGFPBF-PKNBQFBNSA-N
XLogP3.41
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4-methyl-3-propan-2-ylidenehexan-2-imine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,5-Dimethylcyclohex-2-en-1-imine
CID 12562472
4,5,6-Triethylcyclohex-4-en-2-yn-1-imine
CID 57136029
(E)-5-ethyl-6-methylundec-6-en-4-imine
CID 89117109
(Z)-4,5-dimethylhept-5-en-2-imine
CID 89961034
(Z)-5-imino-2,6-dimethyl-4-propan-2-ylhept-3-en-3-amine
CID 90075918
(E)-5-cyclobutyl-4-ethylhex-4-ene-2,3-diimine
CID 90713365
2,2,3,4,5-Pentamethylcyclopent-3-en-1-imine
CID 90908321
3,4-Dimethyloct-3-en-2-imine
CID 91072612
(Z)-5-ethyl-3-methyloct-3-en-2-imine
CID 91076242
2,5-Dimethylhept-1-en-3-imine
CID 91222633
2,3,4,5,5-Pentamethylcyclopent-2-en-1-imine
CID 91273263
(E)-3,4,5-trimethylhex-3-en-2-imine
CID 117717663

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-propan-2-ylidenehexan-2-imine?
The IUPAC name of 4-methyl-3-propan-2-ylidenehexan-2-imine (CID 154973518) is 4-methyl-3-propan-2-ylidenehexan-2-imine.
What is the SMILES notation for 4-methyl-3-propan-2-ylidenehexan-2-imine?
The canonical SMILES for 4-methyl-3-propan-2-ylidenehexan-2-imine is [H]/N=C(\C)C(=C(C)C)C(C)CC.
What is the InChIKey of 4-methyl-3-propan-2-ylidenehexan-2-imine?
The InChIKey is ISUJFSLHOGFPBF-PKNBQFBNSA-N. The full InChI is InChI=1S/C10H19N/c1-6-8(4)10(7(2)3)9(5)11/h8,11H,6H2,1-5H3/b11-9+.
What are the key properties of 4-methyl-3-propan-2-ylidenehexan-2-imine?
4-methyl-3-propan-2-ylidenehexan-2-imine has a molecular weight of 153.27 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-propan-2-ylidenehexan-2-imine is sourced from PubChem (CID 154973518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).