2-(3,6-dihydro-2H-pyridin-1-yl)acetamide

C7H12N2O — CID 14536651

IUPAC2-(3,6-dihydro-2H-pyridin-1-yl)acetamide
SMILESNC(=O)CN1CC=CCC1
InChIInChI=1S/C7H12N2O/c8-7(10)6-9-4-2-1-3-5-9/h1-2H,3-6H2,(H2,8,10)
InChIKeyMMXLRWPXCNSJQZ-UHFFFAOYSA-N
MW140.19 g/mol
LogP-0.27
Rot. Bonds2

About 2-(3,6-dihydro-2H-pyridin-1-yl)acetamide

2-(3,6-dihydro-2H-pyridin-1-yl)acetamide (PubChem CID 14536651) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 2-(3,6-dihydro-2H-pyridin-1-yl)acetamide.

Molecular Properties

Compound Name2-(3,6-dihydro-2H-pyridin-1-yl)acetamide
PubChem CID14536651
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name2-(3,6-dihydro-2H-pyridin-1-yl)acetamide
SMILESNC(=O)CN1CC=CCC1
InChIInChI=1S/C7H12N2O/c8-7(10)6-9-4-2-1-3-5-9/h1-2H,3-6H2,(H2,8,10)
InChIKeyMMXLRWPXCNSJQZ-UHFFFAOYSA-N
XLogP-0.27
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 5-0.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(3,6-dihydro-2H-pyridin-1-yl)acetamide?
The IUPAC name of 2-(3,6-dihydro-2H-pyridin-1-yl)acetamide (CID 14536651) is 2-(3,6-dihydro-2H-pyridin-1-yl)acetamide.
What is the SMILES notation for 2-(3,6-dihydro-2H-pyridin-1-yl)acetamide?
The canonical SMILES for 2-(3,6-dihydro-2H-pyridin-1-yl)acetamide is NC(=O)CN1CC=CCC1.
What is the InChIKey of 2-(3,6-dihydro-2H-pyridin-1-yl)acetamide?
The InChIKey is MMXLRWPXCNSJQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c8-7(10)6-9-4-2-1-3-5-9/h1-2H,3-6H2,(H2,8,10).
What are the key properties of 2-(3,6-dihydro-2H-pyridin-1-yl)acetamide?
2-(3,6-dihydro-2H-pyridin-1-yl)acetamide has a molecular weight of 140.19 g/mol, XLogP of -0.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,6-dihydro-2H-pyridin-1-yl)acetamide is sourced from PubChem (CID 14536651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).