[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate

C14H22N2O4 — CID 19862604

IUPAC[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate
SMILESCCN(CC)C(=O)Oc1c(C)n(CCOC)ccc1=O
InChIInChI=1S/C14H22N2O4/c1-5-15(6-2)14(18)20-13-11(3)16(9-10-19-4)8-7-12(13)17/h7-8H,5-6,9-10H2,1-4H3
InChIKeySHJPPEJLXFYRTD-UHFFFAOYSA-N
MW282.34 g/mol
LogP1.64
Rot. Bonds6

About [1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate

[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate (PubChem CID 19862604) has the molecular formula C14H22N2O4 and a molecular weight of 282.34 g/mol. Its IUPAC name is [1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate.

Molecular Properties

Compound Name[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate
PubChem CID19862604
Molecular FormulaC14H22N2O4
Molecular Weight282.34 g/mol
Exact Mass282.16
IUPAC Name[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate
SMILESCCN(CC)C(=O)Oc1c(C)n(CCOC)ccc1=O
InChIInChI=1S/C14H22N2O4/c1-5-15(6-2)14(18)20-13-11(3)16(9-10-19-4)8-7-12(13)17/h7-8H,5-6,9-10H2,1-4H3
InChIKeySHJPPEJLXFYRTD-UHFFFAOYSA-N
XLogP1.64
TPSA60.77 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-(ethoxycarbonylmethylaminocarbonyloxy)-1-(3-ethoxypropyl)-2-methyl-4(1H)-pyridinone
CID 19862586
3-(ethoxycarbonylmethylaminocarbonyloxy)-1,2-dimethyl-4(1H)-pyridinone
CID 19862590
Ethyl 2-[(1-ethyl-2-methyl-4-oxo-3-pyridinyl)oxycarbonylamino]acetate
CID 19862595
Ethyl 3-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxycarbonylamino]propanoate
CID 19862596
Ethyl 2-[[1-(2-ethoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxycarbonylamino]acetate
CID 19862599
3-(ethoxycarbonylmethylaminocarbonyloxy)-1-(2-methoxyethyl)-2-methyl-4(1H)-pyridinone
CID 19862602
Ethyl [1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] carbonate
CID 19862603
3-(diethylaminocarbonyloxy)-1,2-dimethyl-4(1H)-pyridinone
CID 19862605
3-(ethoxycarbonylmethylaminocarbonyloxy)-2-ethyl-1-methyl-4(1H)-pyridinone
CID 19862606
Ethyl 2-[(2-methyl-4-oxo-1-propyl-3-pyridinyl)oxycarbonylamino]acetate
CID 19862607
[1-(2-ethoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate
CID 19862608
[1-(2-Ethoxyethyl)-2-methyl-4-oxo-3-pyridinyl] ethyl carbonate
CID 19862609

Frequently Asked Questions

What is the IUPAC name of [1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate?
The IUPAC name of [1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate (CID 19862604) is [1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate.
What is the SMILES notation for [1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate?
The canonical SMILES for [1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate is CCN(CC)C(=O)Oc1c(C)n(CCOC)ccc1=O.
What is the InChIKey of [1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate?
The InChIKey is SHJPPEJLXFYRTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O4/c1-5-15(6-2)14(18)20-13-11(3)16(9-10-19-4)8-7-12(13)17/h7-8H,5-6,9-10H2,1-4H3.
What are the key properties of [1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate?
[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate has a molecular weight of 282.34 g/mol, XLogP of 1.64, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl] N,N-diethylcarbamate is sourced from PubChem (CID 19862604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).