2-(diethylcarbamoylamino)-N-ethylacetamide

C9H19N3O2 — CID 115583198

IUPAC2-(diethylcarbamoylamino)-N-ethylacetamide
SMILESCCNC(=O)CNC(=O)N(CC)CC
InChIInChI=1S/C9H19N3O2/c1-4-10-8(13)7-11-9(14)12(5-2)6-3/h4-7H2,1-3H3,(H,10,13)(H,11,14)
InChIKeyVYYDBNSTYMXULO-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.17
Rot. Bonds5

About 2-(diethylcarbamoylamino)-N-ethylacetamide

2-(diethylcarbamoylamino)-N-ethylacetamide (PubChem CID 115583198) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-(diethylcarbamoylamino)-N-ethylacetamide.

Molecular Properties

Compound Name2-(diethylcarbamoylamino)-N-ethylacetamide
PubChem CID115583198
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC Name2-(diethylcarbamoylamino)-N-ethylacetamide
SMILESCCNC(=O)CNC(=O)N(CC)CC
InChIInChI=1S/C9H19N3O2/c1-4-10-8(13)7-11-9(14)12(5-2)6-3/h4-7H2,1-3H3,(H,10,13)(H,11,14)
InChIKeyVYYDBNSTYMXULO-UHFFFAOYSA-N
XLogP0.17
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(diethylcarbamoylamino)-N-propylacetamide
CID 115575868
N-tert-butyl-2-(diethylcarbamoylamino)acetamide
CID 115575873
3-(2-bromoprop-2-enyl)-1,1-diethylurea
CID 115595139
ethyl 2-(diethylcarbamoylamino)acetate
CID 43385178
N-ethyl-2-(phosphanylcarbonylamino)acetamide
CID 156853608
2-(diethylcarbamoylamino)-N-(2-morpholin-4-ylethyl)acetamide
CID 110285196
2-[(2-bromoacetyl)amino]-N-ethylacetamide
CID 58987159
2-[tert-butylcarbamoyl(ethyl)amino]-N-ethylacetamide
CID 115571895
3-[ethyl-[[2-oxo-2-(propylamino)ethyl]carbamoyl]amino]-2-methylpropanoic acid
CID 55123161
N-ethyl-2-(methylamino)acetamide;hydrochloride
CID 18526161
N,N'-diethylpropanediamide
CID 4600245
2-[diethylcarbamoyl(methyl)amino]-N-ethylacetamide
CID 115618628

Frequently Asked Questions

What is the IUPAC name of 2-(diethylcarbamoylamino)-N-ethylacetamide?
The IUPAC name of 2-(diethylcarbamoylamino)-N-ethylacetamide (CID 115583198) is 2-(diethylcarbamoylamino)-N-ethylacetamide.
What is the SMILES notation for 2-(diethylcarbamoylamino)-N-ethylacetamide?
The canonical SMILES for 2-(diethylcarbamoylamino)-N-ethylacetamide is CCNC(=O)CNC(=O)N(CC)CC.
What is the InChIKey of 2-(diethylcarbamoylamino)-N-ethylacetamide?
The InChIKey is VYYDBNSTYMXULO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-4-10-8(13)7-11-9(14)12(5-2)6-3/h4-7H2,1-3H3,(H,10,13)(H,11,14).
What are the key properties of 2-(diethylcarbamoylamino)-N-ethylacetamide?
2-(diethylcarbamoylamino)-N-ethylacetamide has a molecular weight of 201.27 g/mol, XLogP of 0.17, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylcarbamoylamino)-N-ethylacetamide is sourced from PubChem (CID 115583198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).