(Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine

C9H18N2 — CID 134387761

IUPAC(Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine
SMILES[H]/N=C(C)/C(=C(/C)N)C(C)(C)C
InChIInChI=1S/C9H18N2/c1-6(10)8(7(2)11)9(3,4)5/h10H,11H2,1-5H3/b8-7+,10-6+
InChIKeyGOBLQWYJLNMVPZ-IQXTZUCASA-N
MW154.26 g/mol
LogP2.30
Rot. Bonds1

About (Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine

(Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine (PubChem CID 134387761) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is (Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine.

Molecular Properties

Compound Name(Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine
PubChem CID134387761
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name(Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine
SMILES[H]/N=C(C)/C(=C(/C)N)C(C)(C)C
InChIInChI=1S/C9H18N2/c1-6(10)8(7(2)11)9(3,4)5/h10H,11H2,1-5H3/b8-7+,10-6+
InChIKeyGOBLQWYJLNMVPZ-IQXTZUCASA-N
XLogP2.30
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(Z)-5-imino-2,6-dimethyl-4-propan-2-ylhept-3-en-3-amine
CID 90075918
(Z)-4-imino-3,5-dimethylhex-2-en-2-amine
CID 118348642
(Z)-6-imino-4-methylhept-3-en-3-amine
CID 130414211
3-Tert-butyl-4-methylpent-3-en-2-imine
CID 134238673
(Z)-3-ethanimidoyl-4-methylpent-2-en-2-amine
CID 139389307
(Z)-3-ethyl-4-iminohex-2-en-2-amine
CID 142555110
ethane;(Z)-4-imino-3-methylpent-2-en-2-amine
CID 143449462
(Z)-3-ethyl-4-iminopent-2-en-2-amine
CID 143730500
(2E)-2-(1-aminoethylidene)-3-imino-4,4-dimethylpentanenitrile;ethane
CID 143962785
ethane;(Z)-4-imino-3,5,5-trimethylhex-2-en-2-amine;molecular hydrogen
CID 143962808
(Z)-4-imino-3,5,5-trimethylhex-2-en-2-amine
CID 143962809
ethane;(Z)-4-imino-3-methylpent-2-en-2-amine;molecular hydrogen
CID 143988937

Frequently Asked Questions

What is the IUPAC name of (Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine?
The IUPAC name of (Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine (CID 134387761) is (Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine.
What is the SMILES notation for (Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine?
The canonical SMILES for (Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine is [H]/N=C(C)/C(=C(/C)N)C(C)(C)C.
What is the InChIKey of (Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine?
The InChIKey is GOBLQWYJLNMVPZ-IQXTZUCASA-N. The full InChI is InChI=1S/C9H18N2/c1-6(10)8(7(2)11)9(3,4)5/h10H,11H2,1-5H3/b8-7+,10-6+.
What are the key properties of (Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine?
(Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine has a molecular weight of 154.26 g/mol, XLogP of 2.30, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-ethanimidoyl-4,4-dimethylpent-2-en-2-amine is sourced from PubChem (CID 134387761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).