2-(1,4-dihydropyridin-2-yl)acetamide

C7H10N2O — CID 139632179

IUPAC2-(1,4-dihydropyridin-2-yl)acetamide
SMILESNC(=O)CC1=CCC=CN1
InChIInChI=1S/C7H10N2O/c8-7(10)5-6-3-1-2-4-9-6/h2-4,9H,1,5H2,(H2,8,10)
InChIKeyIHUQVULUUABIRO-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.25
Rot. Bonds2

About 2-(1,4-dihydropyridin-2-yl)acetamide

2-(1,4-dihydropyridin-2-yl)acetamide (PubChem CID 139632179) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-(1,4-dihydropyridin-2-yl)acetamide.

Molecular Properties

Compound Name2-(1,4-dihydropyridin-2-yl)acetamide
PubChem CID139632179
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name2-(1,4-dihydropyridin-2-yl)acetamide
SMILESNC(=O)CC1=CCC=CN1
InChIInChI=1S/C7H10N2O/c8-7(10)5-6-3-1-2-4-9-6/h2-4,9H,1,5H2,(H2,8,10)
InChIKeyIHUQVULUUABIRO-UHFFFAOYSA-N
XLogP0.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1,4-dihydropyridin-2-yl)acetamide?
The IUPAC name of 2-(1,4-dihydropyridin-2-yl)acetamide (CID 139632179) is 2-(1,4-dihydropyridin-2-yl)acetamide.
What is the SMILES notation for 2-(1,4-dihydropyridin-2-yl)acetamide?
The canonical SMILES for 2-(1,4-dihydropyridin-2-yl)acetamide is NC(=O)CC1=CCC=CN1.
What is the InChIKey of 2-(1,4-dihydropyridin-2-yl)acetamide?
The InChIKey is IHUQVULUUABIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c8-7(10)5-6-3-1-2-4-9-6/h2-4,9H,1,5H2,(H2,8,10).
What are the key properties of 2-(1,4-dihydropyridin-2-yl)acetamide?
2-(1,4-dihydropyridin-2-yl)acetamide has a molecular weight of 138.17 g/mol, XLogP of 0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4-dihydropyridin-2-yl)acetamide is sourced from PubChem (CID 139632179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).