3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide

C10H21N3O4 — CID 62015172

IUPAC3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)CCN(C)CC(O)COC
InChIInChI=1S/C10H21N3O4/c1-11-10(16)12-9(15)4-5-13(2)6-8(14)7-17-3/h8,14H,4-7H2,1-3H3,(H2,11,12,15,16)
InChIKeyXWJJABUDGFIOGT-UHFFFAOYSA-N
MW247.29 g/mol
LogP-1.23
Rot. Bonds7

About 3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide

3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide (PubChem CID 62015172) has the molecular formula C10H21N3O4 and a molecular weight of 247.29 g/mol. Its IUPAC name is 3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide.

Molecular Properties

Compound Name3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide
PubChem CID62015172
Molecular FormulaC10H21N3O4
Molecular Weight247.29 g/mol
Exact Mass247.15
IUPAC Name3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide
SMILESCNC(=O)NC(=O)CCN(C)CC(O)COC
InChIInChI=1S/C10H21N3O4/c1-11-10(16)12-9(15)4-5-13(2)6-8(14)7-17-3/h8,14H,4-7H2,1-3H3,(H2,11,12,15,16)
InChIKeyXWJJABUDGFIOGT-UHFFFAOYSA-N
XLogP-1.23
TPSA90.90 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.29
LogP ≤ 5-1.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Acetamidopropyl-(2-hydroxy-3-methoxypropyl)-dimethylazanium
CID 21040770
N-(2-hydroxy-3-methoxypropyl)-3-(methylamino)propanamide
CID 22956478
3-amino-N-(2-hydroxy-3-methoxypropyl)propanamide
CID 59892302
N-(3-ethoxy-2-hydroxypropyl)-N-[oxiran-2-ylmethyl(oxiran-2-ylmethylcarbamoyl)carbamoyl]acetamide
CID 139352309
N-[[2,3-dihydroxypropyl(methoxymethyl)amino]methyl]acetamide
CID 156682182
[3-[Acetyl-[1-(methylamino)ethyl]amino]-2-hydroxypropyl] propanoate
CID 164079693
3-amino-N-[bis(2-hydroxyethyl)carbamoyl]propanamide
CID 175712874
3-(2,3-dihydroxypropylamino)-N-[2-(ethylcarbamoylamino)-2-oxoethyl]propanamide
CID 178622252
N-[3-[(2-hydroxy-3-methoxypropyl)-methylamino]-3-oxopropyl]-2,2-dimethylpropanamide
CID 54993388
N-(3-aminopropyl)-3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-methylpropanamide
CID 54993665
1-(2-Hydroxy-3-methoxypropyl)-1-methyl-3-propylurea
CID 60782135
3-Ethyl-1-(2-hydroxy-3-methoxypropyl)-1-methylurea
CID 60793027

Frequently Asked Questions

What is the IUPAC name of 3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide?
The IUPAC name of 3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide (CID 62015172) is 3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide.
What is the SMILES notation for 3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide?
The canonical SMILES for 3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide is CNC(=O)NC(=O)CCN(C)CC(O)COC.
What is the InChIKey of 3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide?
The InChIKey is XWJJABUDGFIOGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O4/c1-11-10(16)12-9(15)4-5-13(2)6-8(14)7-17-3/h8,14H,4-7H2,1-3H3,(H2,11,12,15,16).
What are the key properties of 3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide?
3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide has a molecular weight of 247.29 g/mol, XLogP of -1.23, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-hydroxy-3-methoxypropyl)-methylamino]-N-(methylcarbamoyl)propanamide is sourced from PubChem (CID 62015172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).