ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine

C11H24N2 — CID 162681965

IUPACethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine
SMILESCC.CC(C)=C(N)/C(C)=N/C(C)C
InChIInChI=1S/C9H18N2.C2H6/c1-6(2)9(10)8(5)11-7(3)4;1-2/h7H,10H2,1-5H3;1-2H3/b11-8+;
InChIKeyZJCWJVILFAMMMJ-YGCVIUNWSA-N
MW184.33 g/mol
LogP3.13
Rot. Bonds2

About ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine

ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine (PubChem CID 162681965) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine.

Molecular Properties

Compound Nameethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine
PubChem CID162681965
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Nameethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine
SMILESCC.CC(C)=C(N)/C(C)=N/C(C)C
InChIInChI=1S/C9H18N2.C2H6/c1-6(2)9(10)8(5)11-7(3)4;1-2/h7H,10H2,1-5H3;1-2H3/b11-8+;
InChIKeyZJCWJVILFAMMMJ-YGCVIUNWSA-N
XLogP3.13
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine 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

(Z)-3-methyl-4-methyliminopent-2-en-2-amine
CID 59104563
3-Methyl-4-methyliminopent-2-en-2-amine
CID 72517933
(Z)-N,3-dimethyl-N-propan-2-yl-4-propan-2-yliminopent-2-en-2-amine
CID 90213447
2-Methyl-4-pentan-2-yliminopent-2-en-3-amine
CID 123336491
(E)-3-methyl-2-N-(3-methylbut-3-en-2-ylidene)pent-2-ene-1,2-diimine
CID 123601744
(E)-4-N-ethylidene-3-methylpent-3-ene-2,4-diimine
CID 123915040
3,4-dimethyl-N-propan-2-ylpent-3-en-2-imine
CID 124006658
4-methyl-3-N-(2-methylbutylidene)pent-3-ene-2,3-diimine
CID 126599283
(Z)-3-methyl-N-propan-2-yl-4-propan-2-yliminopent-2-en-2-amine
CID 126613749
3-methyl-N-propan-2-yl-4-propan-2-yliminopent-2-en-2-amine
CID 126613750
(Z)-4-ethylimino-3-methylpent-2-en-2-amine
CID 132246404
(E)-4-propan-2-yliminopent-2-en-3-amine
CID 134465211

Frequently Asked Questions

What is the IUPAC name of ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine?
The IUPAC name of ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine (CID 162681965) is ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine.
What is the SMILES notation for ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine?
The canonical SMILES for ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine is CC.CC(C)=C(N)/C(C)=N/C(C)C.
What is the InChIKey of ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine?
The InChIKey is ZJCWJVILFAMMMJ-YGCVIUNWSA-N. The full InChI is InChI=1S/C9H18N2.C2H6/c1-6(2)9(10)8(5)11-7(3)4;1-2/h7H,10H2,1-5H3;1-2H3/b11-8+;.
What are the key properties of ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine?
ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine has a molecular weight of 184.33 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methyl-4-propan-2-yliminopent-2-en-3-amine is sourced from PubChem (CID 162681965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).