N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide

C17H20N2O4S — CID 51088953

IUPACN-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide
SMILESCCCOc1cccc(C(=O)Nc2ccccc2NS(C)(=O)=O)c1
InChIInChI=1S/C17H20N2O4S/c1-3-11-23-14-8-6-7-13(12-14)17(20)18-15-9-4-5-10-16(15)19-24(2,21)22/h4-10,12,19H,3,11H2,1-2H3,(H,18,20)
InChIKeySOSWYNYPJXENKV-UHFFFAOYSA-N
MW348.42 g/mol
LogP3.10
Rot. Bonds7

About N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide

N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide (PubChem CID 51088953) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide.

Molecular Properties

Compound NameN-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide
PubChem CID51088953
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC NameN-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide
SMILESCCCOc1cccc(C(=O)Nc2ccccc2NS(C)(=O)=O)c1
InChIInChI=1S/C17H20N2O4S/c1-3-11-23-14-8-6-7-13(12-14)17(20)18-15-9-4-5-10-16(15)19-24(2,21)22/h4-10,12,19H,3,11H2,1-2H3,(H,18,20)
InChIKeySOSWYNYPJXENKV-UHFFFAOYSA-N
XLogP3.10
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide
CID 35368167
N-[1-[2-(methanesulfonamido)phenyl]ethyl]-3-propoxybenzamide
CID 55933853
3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide
CID 4958088
N-[2-(difluoromethoxy)phenyl]-3-propoxybenzamide
CID 2067465
3-propoxy-N-[2-[(3-propoxybenzoyl)amino]ethyl]benzamide
CID 4960567
N'-benzoyl-3-propoxybenzohydrazide
CID 4960188
N-[4-(2-phenoxyethoxy)phenyl]-3-propoxybenzamide
CID 4960126
N-benzyl-2-[(3-propoxybenzoyl)amino]benzamide
CID 4960084
3-propoxy-N-[3-[(3-propoxybenzoyl)amino]propyl]benzamide
CID 4960565
N-(4-anilinophenyl)-3-propoxybenzamide
CID 4960017
N-(2-chloro-4-hydroxyphenyl)-3-propoxybenzamide
CID 64789293
N-(4-bromo-2-methylphenyl)-3-propoxybenzamide
CID 2293914

Frequently Asked Questions

What is the IUPAC name of N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide?
The IUPAC name of N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide (CID 51088953) is N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide.
What is the SMILES notation for N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide?
The canonical SMILES for N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide is CCCOc1cccc(C(=O)Nc2ccccc2NS(C)(=O)=O)c1.
What is the InChIKey of N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide?
The InChIKey is SOSWYNYPJXENKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-3-11-23-14-8-6-7-13(12-14)17(20)18-15-9-4-5-10-16(15)19-24(2,21)22/h4-10,12,19H,3,11H2,1-2H3,(H,18,20).
What are the key properties of N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide?
N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide has a molecular weight of 348.42 g/mol, XLogP of 3.10, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methanesulfonamido)phenyl]-3-propoxybenzamide is sourced from PubChem (CID 51088953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).