2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide

C13H19N3O3 — CID 27868610

IUPAC2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide
SMILESCCCNC(=O)CNC(=O)Nc1ccccc1OC
InChIInChI=1S/C13H19N3O3/c1-3-8-14-12(17)9-15-13(18)16-10-6-4-5-7-11(10)19-2/h4-7H,3,8-9H2,1-2H3,(H,14,17)(H2,15,16,18)
InChIKeyLTHMTMDZOHWWJJ-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.34
Rot. Bonds6

About 2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide

2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide (PubChem CID 27868610) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide.

Molecular Properties

Compound Name2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide
PubChem CID27868610
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide
SMILESCCCNC(=O)CNC(=O)Nc1ccccc1OC
InChIInChI=1S/C13H19N3O3/c1-3-8-14-12(17)9-15-13(18)16-10-6-4-5-7-11(10)19-2/h4-7H,3,8-9H2,1-2H3,(H,14,17)(H2,15,16,18)
InChIKeyLTHMTMDZOHWWJJ-UHFFFAOYSA-N
XLogP1.34
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-chloroprop-2-enyl)-3-(2-methoxyphenyl)urea
CID 115640180
2-(2-methoxyanilino)-N-(propylcarbamoyl)acetamide
CID 37472990
N-butyl-N'-(2-methoxyphenyl)propanediamide
CID 108941476
1-(2-azidoethyl)-3-(2-methoxyphenyl)urea
CID 61342696
1-(3-aminopropyl)-3-(2-methoxyphenyl)urea
CID 62267554
1-[2-(2-methoxyphenoxy)ethyl]-3-(2-methoxyphenyl)urea
CID 17171255
4-N-(2-methoxyphenyl)-1-N-propylcyclohexane-1,4-dicarboxamide
CID 109144383
N-(2-aminoethyl)-2-(2-methoxyanilino)acetamide
CID 119382687
1-[(2S)-2-hydroxy-2-methylbutyl]-3-(2-methoxyphenyl)urea
CID 94813267
2-[1-(2-methoxyphenyl)propan-2-ylamino]-N-propylacetamide
CID 43777802
1-[3-(2-ethoxyphenyl)propyl]-3-(2-methoxyphenyl)urea
CID 100747319
N-butyl-N'-(2-methoxyphenyl)oxamide
CID 2247832

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide?
The IUPAC name of 2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide (CID 27868610) is 2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide.
What is the SMILES notation for 2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide?
The canonical SMILES for 2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide is CCCNC(=O)CNC(=O)Nc1ccccc1OC.
What is the InChIKey of 2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide?
The InChIKey is LTHMTMDZOHWWJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-3-8-14-12(17)9-15-13(18)16-10-6-4-5-7-11(10)19-2/h4-7H,3,8-9H2,1-2H3,(H,14,17)(H2,15,16,18).
What are the key properties of 2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide?
2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide has a molecular weight of 265.31 g/mol, XLogP of 1.34, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenyl)carbamoylamino]-N-propylacetamide is sourced from PubChem (CID 27868610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).