ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate

C7H14N2O3 — CID 60652344

IUPACethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate
SMILESCCOC(=O)NCC(=O)N(C)C
InChIInChI=1S/C7H14N2O3/c1-4-12-7(11)8-5-6(10)9(2)3/h4-5H2,1-3H3,(H,8,11)
InChIKeySWAYBCSNUYIRPW-UHFFFAOYSA-N
MW174.20 g/mol
LogP-0.18
Rot. Bonds3

About ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate

ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate (PubChem CID 60652344) has the molecular formula C7H14N2O3 and a molecular weight of 174.20 g/mol. Its IUPAC name is ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate
PubChem CID60652344
Molecular FormulaC7H14N2O3
Molecular Weight174.20 g/mol
Exact Mass174.10
IUPAC Nameethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate
SMILESCCOC(=O)NCC(=O)N(C)C
InChIInChI=1S/C7H14N2O3/c1-4-12-7(11)8-5-6(10)9(2)3/h4-5H2,1-3H3,(H,8,11)
InChIKeySWAYBCSNUYIRPW-UHFFFAOYSA-N
XLogP-0.18
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 145279324
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ethyl N-propylcarbamate
CID 12199
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CID 18709961
ethyl N-[3-(ethoxycarbonylamino)-2,2-bis[(ethoxycarbonylamino)methyl]propyl]carbamate
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ethyl N-(2-iminobutyl)carbamate
CID 174657995
ethyl N-(3-iodoprop-2-ynyl)carbamate
CID 19426393
ethyl 2-(propoxycarbonylamino)acetate
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ethyl N-(carbamoyloxymethyl)carbamate
CID 173418531
N-[2-(dimethylamino)-2-oxoethyl]-2,2-dimethylpropanamide
CID 60667715
ethyl N-[2-(methylamino)ethyl]carbamate
CID 20763174
hexyl 2-(ethoxycarbonylamino)acetate
CID 6421848

Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate?
The IUPAC name of ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate (CID 60652344) is ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate.
What is the SMILES notation for ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate?
The canonical SMILES for ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate is CCOC(=O)NCC(=O)N(C)C.
What is the InChIKey of ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate?
The InChIKey is SWAYBCSNUYIRPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3/c1-4-12-7(11)8-5-6(10)9(2)3/h4-5H2,1-3H3,(H,8,11).
What are the key properties of ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate?
ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate has a molecular weight of 174.20 g/mol, XLogP of -0.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-(dimethylamino)-2-oxoethyl]carbamate is sourced from PubChem (CID 60652344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).