2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide

C12H16N2O3 — CID 166298210

IUPAC2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide
SMILESCc1ccnc(N(C)C(=O)CC2OCCO2)c1
InChIInChI=1S/C12H16N2O3/c1-9-3-4-13-10(7-9)14(2)11(15)8-12-16-5-6-17-12/h3-4,7,12H,5-6,8H2,1-2H3
InChIKeyZNSSQRQHDXZVFB-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.12
Rot. Bonds3

About 2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide

2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide (PubChem CID 166298210) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide
PubChem CID166298210
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC Name2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide
SMILESCc1ccnc(N(C)C(=O)CC2OCCO2)c1
InChIInChI=1S/C12H16N2O3/c1-9-3-4-13-10(7-9)14(2)11(15)8-12-16-5-6-17-12/h3-4,7,12H,5-6,8H2,1-2H3
InChIKeyZNSSQRQHDXZVFB-UHFFFAOYSA-N
XLogP1.12
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide (CID 166298210) is 2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide is Cc1ccnc(N(C)C(=O)CC2OCCO2)c1.
What is the InChIKey of 2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide?
The InChIKey is ZNSSQRQHDXZVFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-9-3-4-13-10(7-9)14(2)11(15)8-12-16-5-6-17-12/h3-4,7,12H,5-6,8H2,1-2H3.
What are the key properties of 2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide?
2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide has a molecular weight of 236.27 g/mol, XLogP of 1.12, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dioxolan-2-yl)-N-methyl-N-(4-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 166298210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).