N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide

C10H18N2O — CID 565875

IUPACN-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide
SMILESCC(=O)NC(C)C1=CCN(C)CC1
InChIInChI=1S/C10H18N2O/c1-8(11-9(2)13)10-4-6-12(3)7-5-10/h4,8H,5-7H2,1-3H3,(H,11,13)
InChIKeySIHSVAQPFZTHSX-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.77
Rot. Bonds2

About N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide

N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide (PubChem CID 565875) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide
PubChem CID565875
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC NameN-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide
SMILESCC(=O)NC(C)C1=CCN(C)CC1
InChIInChI=1S/C10H18N2O/c1-8(11-9(2)13)10-4-6-12(3)7-5-10/h4,8H,5-7H2,1-3H3,(H,11,13)
InChIKeySIHSVAQPFZTHSX-UHFFFAOYSA-N
XLogP0.77
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N1-acetyl-N7-4''-methyl-3''-pentenoyl cadaverine
CID 139591679
N-(2-cyclohexen-1-yl)acetamide
CID 10219472
N-(2-cyclohexa-1,4-dien-1-ylethyl)acetamide
CID 172355103
N-(1-acetylpiperidin-4-yl)-2-methylpent-2-enamide
CID 71896948
(E)-N-(1-acetylpiperidin-4-yl)-2-methylpent-2-enamide
CID 94151524
N-[1-[[1-[(1S)-cyclohex-2-en-1-yl]-3,6-dihydro-2H-pyridin-5-yl]methyl]piperidin-4-yl]acetamide
CID 95124833
4-ethyl-3-(methylamino)-3,6-dihydro-2H-pyridine-1-carbonyl fluoride
CID 59110317
N-(2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-yl)acetamide
CID 14993078
N-[(2S)-4-methylpent-3-en-2-yl]acetamide
CID 134965652
N-[(2R)-6,10-dimethylundeca-5,9-dien-2-yl]acetamide
CID 135075295
N-(5-cyclohexylidenepentyl)acetamide
CID 154717790
N-((1-(2-Cyclohexylideneethyl)-2-pyrrolidinyl)methyl)acetamide
CID 3024074

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide?
The IUPAC name of N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide (CID 565875) is N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide.
What is the SMILES notation for N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide?
The canonical SMILES for N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide is CC(=O)NC(C)C1=CCN(C)CC1.
What is the InChIKey of N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide?
The InChIKey is SIHSVAQPFZTHSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-8(11-9(2)13)10-4-6-12(3)7-5-10/h4,8H,5-7H2,1-3H3,(H,11,13).
What are the key properties of N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide?
N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide has a molecular weight of 182.27 g/mol, XLogP of 0.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl]acetamide is sourced from PubChem (CID 565875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).