N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide

C8H12N2O — CID 143482563

IUPACN-(4-methyl-2,3-dihydropyridin-2-yl)acetamide
SMILESCC(=O)NC1CC(C)=CC=N1
InChIInChI=1S/C8H12N2O/c1-6-3-4-9-8(5-6)10-7(2)11/h3-4,8H,5H2,1-2H3,(H,10,11)
InChIKeyQZFJPCWETWMICP-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.87
Rot. Bonds1

About N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide

N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide (PubChem CID 143482563) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide.

Molecular Properties

Compound NameN-(4-methyl-2,3-dihydropyridin-2-yl)acetamide
PubChem CID143482563
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC NameN-(4-methyl-2,3-dihydropyridin-2-yl)acetamide
SMILESCC(=O)NC1CC(C)=CC=N1
InChIInChI=1S/C8H12N2O/c1-6-3-4-9-8(5-6)10-7(2)11/h3-4,8H,5H2,1-2H3,(H,10,11)
InChIKeyQZFJPCWETWMICP-UHFFFAOYSA-N
XLogP0.87
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dihydropyridin-2-yl)acetamide
CID 89073541
3,5,6,8a-tetrahydro-1H-1,8-naphthyridin-2-one
CID 91185885
N-(2,3-dihydropyridin-4-ylmethyl)acetamide
CID 138478321
3,5-dimethyl-4a,8a-dihydro-1H-1,8-naphthyridin-2-one
CID 141929323
N-[(E)-2-ethyl-4-methyliminobut-2-enyl]acetamide
CID 143514853
2-(methylamino)-N-(5-methyl-2,3-dihydropyridin-2-yl)acetamide
CID 146342605
N-[(Z)-3-(methanimidoyliminomethyl)pent-3-enyl]acetamide
CID 157036972
N-[3-(oxomethylidene)-2H-pyridin-2-yl]propanamide
CID 174299558

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide?
The IUPAC name of N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide (CID 143482563) is N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide.
What is the SMILES notation for N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide?
The canonical SMILES for N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide is CC(=O)NC1CC(C)=CC=N1.
What is the InChIKey of N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide?
The InChIKey is QZFJPCWETWMICP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-6-3-4-9-8(5-6)10-7(2)11/h3-4,8H,5H2,1-2H3,(H,10,11).
What are the key properties of N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide?
N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide has a molecular weight of 152.20 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2,3-dihydropyridin-2-yl)acetamide is sourced from PubChem (CID 143482563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).