(Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine

C7H14N2 — CID 129289758

IUPAC(Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine
SMILESC/C=N/C=C\C(C)(C)N
InChIInChI=1S/C7H14N2/c1-4-9-6-5-7(2,3)8/h4-6H,8H2,1-3H3/b6-5-,9-4+
InChIKeyDONPWMCOXNHKGF-CXBDEZGUSA-N
MW126.20 g/mol
LogP1.33
Rot. Bonds2

About (Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine

(Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine (PubChem CID 129289758) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is (Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine.

Molecular Properties

Compound Name(Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine
PubChem CID129289758
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name(Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine
SMILESC/C=N/C=C\C(C)(C)N
InChIInChI=1S/C7H14N2/c1-4-9-6-5-7(2,3)8/h4-6H,8H2,1-3H3/b6-5-,9-4+
InChIKeyDONPWMCOXNHKGF-CXBDEZGUSA-N
XLogP1.33
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-Methylazepin-4-amine
CID 69476902
(Z)-1-(prop-2-enylideneamino)but-1-en-2-amine
CID 88594373
(E)-1-(prop-2-enylideneamino)but-1-en-2-amine
CID 88976713
(E)-4-(ethylideneamino)but-3-en-1-amine
CID 89257831
N'-[(Z)-but-1-enyl]ethane-1,2-diimine
CID 89425018
N'-[(Z)-3-methylbut-1-enyl]ethane-1,2-diimine
CID 89425047
(Z)-4-(ethylideneamino)but-3-en-1-amine
CID 89468696
4-methyl-3H-pyridin-4-amine
CID 89676489
(Z)-4-N-ethylidenebut-3-ene-2,4-diimine
CID 90382157
2,2-Dimethyl-7,8-dihydro-1,5-diazonine
CID 123571290
1-(Ethylideneamino)pent-1-en-3-amine
CID 123675713
5,5-Dimethyl-1,4-diazepine
CID 123685984

Frequently Asked Questions

What is the IUPAC name of (Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine?
The IUPAC name of (Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine (CID 129289758) is (Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine.
What is the SMILES notation for (Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine?
The canonical SMILES for (Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine is C/C=N/C=C\C(C)(C)N.
What is the InChIKey of (Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine?
The InChIKey is DONPWMCOXNHKGF-CXBDEZGUSA-N. The full InChI is InChI=1S/C7H14N2/c1-4-9-6-5-7(2,3)8/h4-6H,8H2,1-3H3/b6-5-,9-4+.
What are the key properties of (Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine?
(Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine has a molecular weight of 126.20 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-(ethylideneamino)-2-methylbut-3-en-2-amine is sourced from PubChem (CID 129289758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).