2-(diethylamino)-N-prop-2-enylacetamide

C9H18N2O — CID 51050232

IUPAC2-(diethylamino)-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CN(CC)CC
InChIInChI=1S/C9H18N2O/c1-4-7-10-9(12)8-11(5-2)6-3/h4H,1,5-8H2,2-3H3,(H,10,12)
InChIKeyXIDSRLGJNVMVIN-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.63
Rot. Bonds6

About 2-(diethylamino)-N-prop-2-enylacetamide

2-(diethylamino)-N-prop-2-enylacetamide (PubChem CID 51050232) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 2-(diethylamino)-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-(diethylamino)-N-prop-2-enylacetamide
PubChem CID51050232
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name2-(diethylamino)-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CN(CC)CC
InChIInChI=1S/C9H18N2O/c1-4-7-10-9(12)8-11(5-2)6-3/h4H,1,5-8H2,2-3H3,(H,10,12)
InChIKeyXIDSRLGJNVMVIN-UHFFFAOYSA-N
XLogP0.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
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': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[2-(Dimethylamino)ethyl]acrylamide
CID 70218
N-(2-(Diethylamino)ethyl)-2-propenamide
CID 82750
N~1~,N~2~-diallylethanediamide
CID 241033
2-Propen-1-aminium, N-(2-amino-2-oxoethyl)-N,N-dimethyl-
CID 3047472
2-(piperazin-1-yl)-N-(prop-2-en-1-yl)acetamide
CID 8893273
N-[2-(diethylamino)ethyl]acrylamide monohydrochloride
CID 3018509
2-amino-N-(prop-2-en-1-yl)acetamide hydrochloride
CID 53410800
2-amino-N-(prop-2-en-1-yl)acetamide
CID 18446443
N-allyl-4-methyl-piperazine-1-carboxyamide
CID 3229441
2-(4-methylpiperazin-1-yl)-N-prop-2-enylpropanamide
CID 3229462
N,N,N',N'-tetrakis(prop-2-enyl)oxamide
CID 3417533
Ethanaminium, N,N,N-trimethyl-2-[(1-oxo-2-propenyl)amino]-, chloride
CID 9855713

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-prop-2-enylacetamide?
The IUPAC name of 2-(diethylamino)-N-prop-2-enylacetamide (CID 51050232) is 2-(diethylamino)-N-prop-2-enylacetamide.
What is the SMILES notation for 2-(diethylamino)-N-prop-2-enylacetamide?
The canonical SMILES for 2-(diethylamino)-N-prop-2-enylacetamide is C=CCNC(=O)CN(CC)CC.
What is the InChIKey of 2-(diethylamino)-N-prop-2-enylacetamide?
The InChIKey is XIDSRLGJNVMVIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-4-7-10-9(12)8-11(5-2)6-3/h4H,1,5-8H2,2-3H3,(H,10,12).
What are the key properties of 2-(diethylamino)-N-prop-2-enylacetamide?
2-(diethylamino)-N-prop-2-enylacetamide has a molecular weight of 170.26 g/mol, XLogP of 0.63, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-prop-2-enylacetamide is sourced from PubChem (CID 51050232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).