2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide

C13H18N2O2 — CID 136516820

IUPAC2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide
SMILESCc1cc(C)nc(NC(=O)COCC2CC2)c1
InChIInChI=1S/C13H18N2O2/c1-9-5-10(2)14-12(6-9)15-13(16)8-17-7-11-3-4-11/h5-6,11H,3-4,7-8H2,1-2H3,(H,14,15,16)
InChIKeyDRHSJSFUGNMXCL-UHFFFAOYSA-N
MW234.30 g/mol
LogP2.06
Rot. Bonds5

About 2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide

2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide (PubChem CID 136516820) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide
PubChem CID136516820
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide
SMILESCc1cc(C)nc(NC(=O)COCC2CC2)c1
InChIInChI=1S/C13H18N2O2/c1-9-5-10(2)14-12(6-9)15-13(16)8-17-7-11-3-4-11/h5-6,11H,3-4,7-8H2,1-2H3,(H,14,15,16)
InChIKeyDRHSJSFUGNMXCL-UHFFFAOYSA-N
XLogP2.06
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide (CID 136516820) is 2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide is Cc1cc(C)nc(NC(=O)COCC2CC2)c1.
What is the InChIKey of 2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide?
The InChIKey is DRHSJSFUGNMXCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-9-5-10(2)14-12(6-9)15-13(16)8-17-7-11-3-4-11/h5-6,11H,3-4,7-8H2,1-2H3,(H,14,15,16).
What are the key properties of 2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide?
2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide has a molecular weight of 234.30 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide is sourced from PubChem (CID 136516820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).