N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide

C12H17N3O2 — CID 2608330

IUPACN-(ethylcarbamoyl)-2-(N-methylanilino)acetamide
SMILESCCNC(=O)NC(=O)CN(C)c1ccccc1
InChIInChI=1S/C12H17N3O2/c1-3-13-12(17)14-11(16)9-15(2)10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3,(H2,13,14,16,17)
InChIKeyOWCCYVMURPDSMJ-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.97
Rot. Bonds4

About N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide

N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide (PubChem CID 2608330) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-(N-methylanilino)acetamide
PubChem CID2608330
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC NameN-(ethylcarbamoyl)-2-(N-methylanilino)acetamide
SMILESCCNC(=O)NC(=O)CN(C)c1ccccc1
InChIInChI=1S/C12H17N3O2/c1-3-13-12(17)14-11(16)9-15(2)10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3,(H2,13,14,16,17)
InChIKeyOWCCYVMURPDSMJ-UHFFFAOYSA-N
XLogP0.97
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide?
The IUPAC name of N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide (CID 2608330) is N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide.
What is the SMILES notation for N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide?
The canonical SMILES for N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide is CCNC(=O)NC(=O)CN(C)c1ccccc1.
What is the InChIKey of N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide?
The InChIKey is OWCCYVMURPDSMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-3-13-12(17)14-11(16)9-15(2)10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3,(H2,13,14,16,17).
What are the key properties of N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide?
N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide has a molecular weight of 235.29 g/mol, XLogP of 0.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylcarbamoyl)-2-(N-methylanilino)acetamide is sourced from PubChem (CID 2608330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).