(E)-2-methyl-4-(methylamino)pent-2-enamide

C7H14N2O — CID 22497378

IUPAC(E)-2-methyl-4-(methylamino)pent-2-enamide
SMILESCNC(C)/C=C(\C)C(N)=O
InChIInChI=1S/C7H14N2O/c1-5(7(8)10)4-6(2)9-3/h4,6,9H,1-3H3,(H2,8,10)/b5-4+
InChIKeyGHPXRMMPBIUEFV-SNAWJCMRSA-N
MW142.20 g/mol
LogP0.03
Rot. Bonds3

About (E)-2-methyl-4-(methylamino)pent-2-enamide

(E)-2-methyl-4-(methylamino)pent-2-enamide (PubChem CID 22497378) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is (E)-2-methyl-4-(methylamino)pent-2-enamide.

Molecular Properties

Compound Name(E)-2-methyl-4-(methylamino)pent-2-enamide
PubChem CID22497378
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name(E)-2-methyl-4-(methylamino)pent-2-enamide
SMILESCNC(C)/C=C(\C)C(N)=O
InChIInChI=1S/C7H14N2O/c1-5(7(8)10)4-6(2)9-3/h4,6,9H,1-3H3,(H2,8,10)/b5-4+
InChIKeyGHPXRMMPBIUEFV-SNAWJCMRSA-N
XLogP0.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-2-methyl-4-(methylamino)pent-2-enamide?
The IUPAC name of (E)-2-methyl-4-(methylamino)pent-2-enamide (CID 22497378) is (E)-2-methyl-4-(methylamino)pent-2-enamide.
What is the SMILES notation for (E)-2-methyl-4-(methylamino)pent-2-enamide?
The canonical SMILES for (E)-2-methyl-4-(methylamino)pent-2-enamide is CNC(C)/C=C(\C)C(N)=O.
What is the InChIKey of (E)-2-methyl-4-(methylamino)pent-2-enamide?
The InChIKey is GHPXRMMPBIUEFV-SNAWJCMRSA-N. The full InChI is InChI=1S/C7H14N2O/c1-5(7(8)10)4-6(2)9-3/h4,6,9H,1-3H3,(H2,8,10)/b5-4+.
What are the key properties of (E)-2-methyl-4-(methylamino)pent-2-enamide?
(E)-2-methyl-4-(methylamino)pent-2-enamide has a molecular weight of 142.20 g/mol, XLogP of 0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-methyl-4-(methylamino)pent-2-enamide is sourced from PubChem (CID 22497378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).