3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide

C16H25N3O4 — CID 48744646

IUPAC3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide
SMILESCOCCN(CCOC)C(=O)Nc1cccc(C(=O)N(C)C)c1
InChIInChI=1S/C16H25N3O4/c1-18(2)15(20)13-6-5-7-14(12-13)17-16(21)19(8-10-22-3)9-11-23-4/h5-7,12H,8-11H2,1-4H3,(H,17,21)
InChIKeyADKUIYFJPZEVGC-UHFFFAOYSA-N
MW323.39 g/mol
LogP1.52
Rot. Bonds8

About 3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide

3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide (PubChem CID 48744646) has the molecular formula C16H25N3O4 and a molecular weight of 323.39 g/mol. Its IUPAC name is 3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide
PubChem CID48744646
Molecular FormulaC16H25N3O4
Molecular Weight323.39 g/mol
Exact Mass323.18
IUPAC Name3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide
SMILESCOCCN(CCOC)C(=O)Nc1cccc(C(=O)N(C)C)c1
InChIInChI=1S/C16H25N3O4/c1-18(2)15(20)13-6-5-7-14(12-13)17-16(21)19(8-10-22-3)9-11-23-4/h5-7,12H,8-11H2,1-4H3,(H,17,21)
InChIKeyADKUIYFJPZEVGC-UHFFFAOYSA-N
XLogP1.52
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.39
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide 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-(2-methoxyethylcarbamoylamino)-N,N-dimethylbenzamide
CID 47201886
1,1-bis(2-methoxyethyl)-3-(3-methoxyphenyl)urea
CID 108869156
3-[[2-cyanoethyl(2-methoxyethyl)carbamoyl]amino]benzoic acid
CID 63286808
[3-[bis(2-methoxyethyl)carbamoylamino]phenyl] acetate
CID 108865269
3-[3-(1-aminoethyl)phenyl]-1,1-bis(2-methoxyethyl)urea
CID 61418847
3-(3-chlorophenyl)-1-(2-hydroxyethyl)-1-(2-methoxyethyl)urea
CID 110929481
N,N'-bis[3-(dimethylcarbamoyl)phenyl]butanediamide
CID 17232267
methyl 3-(dipropylcarbamoylamino)benzoate
CID 108990977
2-hydroxyethyl N-[3-(dimethylcarbamoyl)phenyl]carbamate
CID 79345340
1-[3-(dimethylamino)propyl]-1-(2-methoxyethyl)-3-phenylurea
CID 38283609
3-bromo-N-[3-(dimethylcarbamoyl)phenyl]-4-(2-methoxyethoxy)benzamide
CID 17231899
3-(3-acetylphenyl)-1,1-bis(2-hydroxyethyl)urea
CID 61347604

Frequently Asked Questions

What is the IUPAC name of 3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide?
The IUPAC name of 3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide (CID 48744646) is 3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide.
What is the SMILES notation for 3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide?
The canonical SMILES for 3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide is COCCN(CCOC)C(=O)Nc1cccc(C(=O)N(C)C)c1.
What is the InChIKey of 3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide?
The InChIKey is ADKUIYFJPZEVGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O4/c1-18(2)15(20)13-6-5-7-14(12-13)17-16(21)19(8-10-22-3)9-11-23-4/h5-7,12H,8-11H2,1-4H3,(H,17,21).
What are the key properties of 3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide?
3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide has a molecular weight of 323.39 g/mol, XLogP of 1.52, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[bis(2-methoxyethyl)carbamoylamino]-N,N-dimethylbenzamide is sourced from PubChem (CID 48744646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).