N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide

C11H20N2O — CID 135128686

IUPACN-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide
SMILESC=CCN(CCN(C)C)C(=O)C(=C)C
InChIInChI=1S/C11H20N2O/c1-6-7-13(9-8-12(4)5)11(14)10(2)3/h6H,1-2,7-9H2,3-5H3
InChIKeyYDLGHBKLQOWLSE-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.14
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide

N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide (PubChem CID 135128686) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide
PubChem CID135128686
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide
SMILESC=CCN(CCN(C)C)C(=O)C(=C)C
InChIInChI=1S/C11H20N2O/c1-6-7-13(9-8-12(4)5)11(14)10(2)3/h6H,1-2,7-9H2,3-5H3
InChIKeyYDLGHBKLQOWLSE-UHFFFAOYSA-N
XLogP1.14
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(8-hydroxyoctyl)-2-methyl-N-prop-2-enylprop-2-enamide
CID 135128662
2-methyl-N-[(E)-4-[2-oxopropanoyl(prop-2-enyl)amino]but-2-enyl]-N-prop-2-enylprop-2-enamide
CID 155454680
2-[[2-(dimethylamino)ethyl-(2-methylpropyl)carbamoyl]-prop-2-enylamino]acetic acid
CID 79276660
butane-2,3-dione;N,N-dimethylprop-2-en-1-amine;hydrochloride
CID 174374169
N-[3-(dimethylamino)propyl]-N-(methoxymethyl)-2-methylprop-2-enamide
CID 151029194
3-prop-1-en-2-yl-1,1-bis(prop-2-enyl)urea
CID 108910247
N-(2-hydroxyethyl)-N-prop-2-enylacetamide
CID 84572947
N,N'-dimethyl-N,N'-bis(prop-2-enyl)oxamide
CID 71483404
N,2-dimethyl-N-[2-[methyl(prop-2-enoyl)amino]ethyl]prop-2-enamide
CID 23525820
(Z)-3-[bis(prop-2-enyl)amino]but-2-enoic acid
CID 21432845
N-(2-oxoethyl)-N-prop-2-enylacetamide
CID 19738524
2-methyl-N-pentyl-N-prop-2-enylprop-2-enamide;(5R)-4-thia-1-azabicyclo[3.2.0]heptan-7-one
CID 174834868

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide (CID 135128686) is N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide is C=CCN(CCN(C)C)C(=O)C(=C)C.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide?
The InChIKey is YDLGHBKLQOWLSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-6-7-13(9-8-12(4)5)11(14)10(2)3/h6H,1-2,7-9H2,3-5H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide?
N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide has a molecular weight of 196.29 g/mol, XLogP of 1.14, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-methyl-N-prop-2-enylprop-2-enamide is sourced from PubChem (CID 135128686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).