N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide

C16H25N3O4S — CID 120582674

IUPACN-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide
SMILESCCC(=O)NCc1cc(S(=O)(=O)NCC(N)C2CC2)ccc1OC
InChIInChI=1S/C16H25N3O4S/c1-3-16(20)18-9-12-8-13(6-7-15(12)23-2)24(21,22)19-10-14(17)11-4-5-11/h6-8,11,14,19H,3-5,9-10,17H2,1-2H3,(H,18,20)
InChIKeyUNAXGHUFHKYTFY-UHFFFAOYSA-N
MW355.46 g/mol
LogP0.74
Rot. Bonds9

About N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide

N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide (PubChem CID 120582674) has the molecular formula C16H25N3O4S and a molecular weight of 355.46 g/mol. Its IUPAC name is N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide.

Molecular Properties

Compound NameN-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide
PubChem CID120582674
Molecular FormulaC16H25N3O4S
Molecular Weight355.46 g/mol
Exact Mass355.16
IUPAC NameN-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide
SMILESCCC(=O)NCc1cc(S(=O)(=O)NCC(N)C2CC2)ccc1OC
InChIInChI=1S/C16H25N3O4S/c1-3-16(20)18-9-12-8-13(6-7-15(12)23-2)24(21,22)19-10-14(17)11-4-5-11/h6-8,11,14,19H,3-5,9-10,17H2,1-2H3,(H,18,20)
InChIKeyUNAXGHUFHKYTFY-UHFFFAOYSA-N
XLogP0.74
TPSA110.52 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.46
LogP ≤ 50.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]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

N-(2-amino-2-cyclopropylethyl)-4-methoxy-3-methylbenzenesulfonamide
CID 115301370
methyl 4-[(2-amino-2-cyclopropylethyl)sulfamoyl]benzoate;hydrochloride
CID 120582816
N-[[2-methoxy-5-[(4-methylpiperidin-3-yl)sulfamoyl]phenyl]methyl]propanamide;hydrochloride
CID 120722908
N-[2-methoxy-5-(2-methylpropylsulfamoyl)phenyl]propanamide
CID 27211549
N-[4-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-bromophenyl]acetamide
CID 120713313
N-[4-[(2-amino-2-cyclopropylethyl)sulfamoyl]phenyl]acetamide
CID 63764900
N-[[5-[(2S)-2-(cyclopropanecarbonyl)morpholin-4-yl]sulfonyl-2-methoxyphenyl]methyl]propanamide
CID 100762123
N-[[5-[(2R)-2-(cyclopropanecarbonyl)morpholin-4-yl]sulfonyl-2-methoxyphenyl]methyl]propanamide
CID 100762127
N-(2-amino-2-cyclopropylethyl)-4-butan-2-ylbenzenesulfonamide
CID 115301404
4-methoxy-N-(2-methoxypropyl)-3-(methylaminomethyl)benzenesulfonamide
CID 102701447
N-(2-amino-2-cyclopropylethyl)-4-(2-methoxyethyl)benzenesulfonamide
CID 120582635
N-(2-amino-2-cyclopropylethyl)-3-bromo-4-fluorobenzenesulfonamide
CID 120582565

Frequently Asked Questions

What is the IUPAC name of N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide?
The IUPAC name of N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide (CID 120582674) is N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide.
What is the SMILES notation for N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide?
The canonical SMILES for N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide is CCC(=O)NCc1cc(S(=O)(=O)NCC(N)C2CC2)ccc1OC.
What is the InChIKey of N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide?
The InChIKey is UNAXGHUFHKYTFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O4S/c1-3-16(20)18-9-12-8-13(6-7-15(12)23-2)24(21,22)19-10-14(17)11-4-5-11/h6-8,11,14,19H,3-5,9-10,17H2,1-2H3,(H,18,20).
What are the key properties of N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide?
N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide has a molecular weight of 355.46 g/mol, XLogP of 0.74, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]-2-methoxyphenyl]methyl]propanamide is sourced from PubChem (CID 120582674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).