N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide

C11H16N2O — CID 91432633

IUPACN,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide
SMILESCC1C=C(C=CC(=O)N(C)C)C=NC1
InChIInChI=1S/C11H16N2O/c1-9-6-10(8-12-7-9)4-5-11(14)13(2)3/h4-6,8-9H,7H2,1-3H3
InChIKeyOHNUEVXUEGAAKK-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.28
Rot. Bonds2

About N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide

N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide (PubChem CID 91432633) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide.

Molecular Properties

Compound NameN,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide
PubChem CID91432633
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC NameN,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide
SMILESCC1C=C(C=CC(=O)N(C)C)C=NC1
InChIInChI=1S/C11H16N2O/c1-9-6-10(8-12-7-9)4-5-11(14)13(2)3/h4-6,8-9H,7H2,1-3H3
InChIKeyOHNUEVXUEGAAKK-UHFFFAOYSA-N
XLogP1.28
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

CID 59369479
CID 59369479
N,N,3-trimethyl-2,3-dihydropyridine-5-carboxamide
CID 68348581
3-(2,3-dihydropyridin-5-yl)-N,N-dimethylprop-2-enamide
CID 90845381
1,6-Dimethyl-5-(methyliminomethyl)pyridin-2-one
CID 123207508
3-[(Z)-but-1-enyl]-1-methyl-4-(methyliminomethyl)-2H-pyrrol-5-one;ethane
CID 143839050
ethane;1-methyl-5-(methyliminomethyl)-4-[(Z)-prop-1-enyl]-2,3-dihydropyridin-6-one
CID 143839053
1-methyl-3-(methyliminomethyl)-4-[(Z)-prop-1-enyl]pyridin-2-one
CID 155041166
Ethane;2-methyl-2,7-naphthyridin-3-one
CID 167522446
2,5-Dimethyl-2,7-naphthyridin-3-one;ethane
CID 167522975
Ethane;2-methyl-2,7-naphthyridin-3-one
CID 167523014
5-(1,2-dimethyl-2H-pyrimidin-5-yl)-1-methylpyridin-2-one
CID 168925354
5-(1-Methyl-2-pyridinylidene)pyridin-2-one
CID 173501836

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide?
The IUPAC name of N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide (CID 91432633) is N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide.
What is the SMILES notation for N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide?
The canonical SMILES for N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide is CC1C=C(C=CC(=O)N(C)C)C=NC1.
What is the InChIKey of N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide?
The InChIKey is OHNUEVXUEGAAKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-9-6-10(8-12-7-9)4-5-11(14)13(2)3/h4-6,8-9H,7H2,1-3H3.
What are the key properties of N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide?
N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide has a molecular weight of 192.26 g/mol, XLogP of 1.28, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide is sourced from PubChem (CID 91432633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).