N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide

C10H18N2O2 — CID 18984068

IUPACN,2-dimethylprop-2-enamide;N-ethylprop-2-enamide
SMILESC=C(C)C(=O)NC.C=CC(=O)NCC
InChIInChI=1S/2C5H9NO/c1-4(2)5(7)6-3;1-3-5(7)6-4-2/h1H2,2-3H3,(H,6,7);3H,1,4H2,2H3,(H,6,7)
InChIKeySCXDNUOUBKXGEZ-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.62
Rot. Bonds3

About N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide

N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide (PubChem CID 18984068) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide.

Molecular Properties

Compound NameN,2-dimethylprop-2-enamide;N-ethylprop-2-enamide
PubChem CID18984068
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC NameN,2-dimethylprop-2-enamide;N-ethylprop-2-enamide
SMILESC=C(C)C(=O)NC.C=CC(=O)NCC
InChIInChI=1S/2C5H9NO/c1-4(2)5(7)6-3;1-3-5(7)6-4-2/h1H2,2-3H3,(H,6,7);3H,1,4H2,2H3,(H,6,7)
InChIKeySCXDNUOUBKXGEZ-UHFFFAOYSA-N
XLogP0.62
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.62
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 N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide?
The IUPAC name of N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide (CID 18984068) is N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide.
What is the SMILES notation for N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide?
The canonical SMILES for N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide is C=C(C)C(=O)NC.C=CC(=O)NCC.
What is the InChIKey of N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide?
The InChIKey is SCXDNUOUBKXGEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H9NO/c1-4(2)5(7)6-3;1-3-5(7)6-4-2/h1H2,2-3H3,(H,6,7);3H,1,4H2,2H3,(H,6,7).
What are the key properties of N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide?
N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide has a molecular weight of 198.27 g/mol, XLogP of 0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethylprop-2-enamide;N-ethylprop-2-enamide is sourced from PubChem (CID 18984068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).