4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide

C13H21N3O4S — CID 65375926

IUPAC4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide
SMILESCOCC(C)NC(=O)c1ccc(N(C)C)c(S(N)(=O)=O)c1
InChIInChI=1S/C13H21N3O4S/c1-9(8-20-4)15-13(17)10-5-6-11(16(2)3)12(7-10)21(14,18)19/h5-7,9H,8H2,1-4H3,(H,15,17)(H2,14,18,19)
InChIKeyNVHRWVDQVYUZJC-UHFFFAOYSA-N
MW315.40 g/mol
LogP0.16
Rot. Bonds6

About 4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide

4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide (PubChem CID 65375926) has the molecular formula C13H21N3O4S and a molecular weight of 315.40 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide
PubChem CID65375926
Molecular FormulaC13H21N3O4S
Molecular Weight315.40 g/mol
Exact Mass315.13
IUPAC Name4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide
SMILESCOCC(C)NC(=O)c1ccc(N(C)C)c(S(N)(=O)=O)c1
InChIInChI=1S/C13H21N3O4S/c1-9(8-20-4)15-13(17)10-5-6-11(16(2)3)12(7-10)21(14,18)19/h5-7,9H,8H2,1-4H3,(H,15,17)(H2,14,18,19)
InChIKeyNVHRWVDQVYUZJC-UHFFFAOYSA-N
XLogP0.16
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.40
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide 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

4-bromo-N-(4-methoxybutan-2-yl)-3-sulfamoylbenzamide
CID 65380192
3-(dimethylsulfamoyl)-4-methoxy-N-[(2R)-1-methoxypropan-2-yl]benzamide
CID 92517191
4-methoxy-N-(4-methoxybutan-2-yl)-3-sulfamoylbenzamide
CID 65381397
1-N,4-N-bis[(2R)-1-methoxypropan-2-yl]benzene-1,4-dicarboxamide
CID 25476067
N-(1-ethoxypropan-2-yl)-4-methoxy-3-sulfamoylbenzamide
CID 65389004
4-(dimethylamino)-N-(1-methoxypropan-2-yl)benzamide
CID 2904147
2-(dimethylamino)-5-(propan-2-ylcarbamoyl)benzenesulfonyl chloride
CID 65368415
2,4-dichloro-N-(1-methoxypropan-2-yl)-5-sulfamoylbenzamide
CID 60637644
N-[(2R)-butan-2-yl]-4-methoxy-3-sulfamoylbenzamide
CID 96561901
4-chloro-N-(1-methoxy-3-methylbutan-2-yl)-3-sulfamoylbenzamide
CID 65381406
N-[(2R)-1-methoxypropan-2-yl]-3,4-dimethylbenzamide
CID 5390617
N-butan-2-yl-4-methyl-3-sulfamoylbenzamide
CID 60681995

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide?
The IUPAC name of 4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide (CID 65375926) is 4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide.
What is the SMILES notation for 4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide?
The canonical SMILES for 4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide is COCC(C)NC(=O)c1ccc(N(C)C)c(S(N)(=O)=O)c1.
What is the InChIKey of 4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide?
The InChIKey is NVHRWVDQVYUZJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O4S/c1-9(8-20-4)15-13(17)10-5-6-11(16(2)3)12(7-10)21(14,18)19/h5-7,9H,8H2,1-4H3,(H,15,17)(H2,14,18,19).
What are the key properties of 4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide?
4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide has a molecular weight of 315.40 g/mol, XLogP of 0.16, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(1-methoxypropan-2-yl)-3-sulfamoylbenzamide is sourced from PubChem (CID 65375926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).