(1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate

C10H14N2O3 — CID 134096695

IUPAC(1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate
SMILESCCn1ccc(=O)c(OC(=O)NC)c1C
InChIInChI=1S/C10H14N2O3/c1-4-12-6-5-8(13)9(7(12)2)15-10(14)11-3/h5-6H,4H2,1-3H3,(H,11,14)
InChIKeyOCJPPSSRBZVLBU-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.89
Rot. Bonds2

About (1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate

(1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate (PubChem CID 134096695) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is (1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate.

Molecular Properties

Compound Name(1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate
PubChem CID134096695
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name(1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate
SMILESCCn1ccc(=O)c(OC(=O)NC)c1C
InChIInChI=1S/C10H14N2O3/c1-4-12-6-5-8(13)9(7(12)2)15-10(14)11-3/h5-6H,4H2,1-3H3,(H,11,14)
InChIKeyOCJPPSSRBZVLBU-UHFFFAOYSA-N
XLogP0.89
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate?
The IUPAC name of (1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate (CID 134096695) is (1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate.
What is the SMILES notation for (1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate?
The canonical SMILES for (1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate is CCn1ccc(=O)c(OC(=O)NC)c1C.
What is the InChIKey of (1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate?
The InChIKey is OCJPPSSRBZVLBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-4-12-6-5-8(13)9(7(12)2)15-10(14)11-3/h5-6H,4H2,1-3H3,(H,11,14).
What are the key properties of (1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate?
(1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate has a molecular weight of 210.23 g/mol, XLogP of 0.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethyl-2-methyl-4-oxo-3-pyridinyl) N-methylcarbamate is sourced from PubChem (CID 134096695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).