N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide

C9H18N2O — CID 18414873

IUPACN-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide
SMILESC=C(C)C(=O)NCCN(C)CC
InChIInChI=1S/C9H18N2O/c1-5-11(4)7-6-10-9(12)8(2)3/h2,5-7H2,1,3-4H3,(H,10,12)
InChIKeyWTEBAMPDNAGVBZ-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.63
Rot. Bonds5

About N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide

N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide (PubChem CID 18414873) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide.

Molecular Properties

Compound NameN-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide
PubChem CID18414873
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide
SMILESC=C(C)C(=O)NCCN(C)CC
InChIInChI=1S/C9H18N2O/c1-5-11(4)7-6-10-9(12)8(2)3/h2,5-7H2,1,3-4H3,(H,10,12)
InChIKeyWTEBAMPDNAGVBZ-UHFFFAOYSA-N
XLogP0.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[dodecyl(methyl)amino]ethyl]-2-methylprop-2-enamide
CID 88943735
ethane;N-[2-[ethyl(methyl)amino]ethyl]acetamide
CID 142011990
N-[2-[ethyl(methyl)amino]ethyl]-2-methylbutanamide
CID 20730110
ethyl 2-[2-[ethyl(methyl)amino]ethylamino]-2-oxoacetate
CID 62635568
N-[3-[3-acetamidopropyl(methyl)amino]propyl]-2-methylprop-2-enamide
CID 87413302
2-methyl-N-[2-[methyl(octa-3,7-dienyl)amino]ethyl]prop-2-enamide
CID 91003328
N-but-1-en-2-yl-N'-ethyl-N'-methylethane-1,2-diamine
CID 176941787
N-[2-[di(propan-2-yl)amino]ethyl]-2-methylprop-2-enamide
CID 87732978
2-methyl-N-propylprop-2-enamide;hydrobromide
CID 172725706
2-methyl-N-propylprop-2-enamide;hydrochloride
CID 87485783
1-ethyl-3-[2-[ethyl(methyl)amino]ethyl]urea
CID 115595346
N-[3-deuterio-3-(dimethylamino)propyl]-2-methylprop-2-enamide
CID 175928918

Frequently Asked Questions

What is the IUPAC name of N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide?
The IUPAC name of N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide (CID 18414873) is N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide.
What is the SMILES notation for N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide?
The canonical SMILES for N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide is C=C(C)C(=O)NCCN(C)CC.
What is the InChIKey of N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide?
The InChIKey is WTEBAMPDNAGVBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-5-11(4)7-6-10-9(12)8(2)3/h2,5-7H2,1,3-4H3,(H,10,12).
What are the key properties of N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide?
N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide has a molecular weight of 170.26 g/mol, XLogP of 0.63, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[ethyl(methyl)amino]ethyl]-2-methylprop-2-enamide is sourced from PubChem (CID 18414873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).