N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide

C22H21N3O3S — CID 169420485

IUPACN-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide
SMILESCS(=O)(=O)Nc1ccc(-c2cccc(C(=O)Nc3ccccc3C3CC3)c2)cn1
InChIInChI=1S/C22H21N3O3S/c1-29(27,28)25-21-12-11-18(14-23-21)16-5-4-6-17(13-16)22(26)24-20-8-3-2-7-19(20)15-9-10-15/h2-8,11-15H,9-10H2,1H3,(H,23,25)(H,24,26)
InChIKeySVRWFAMVABBQTP-UHFFFAOYSA-N
MW407.50 g/mol
LogP4.25
Rot. Bonds6

About N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide

N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide (PubChem CID 169420485) has the molecular formula C22H21N3O3S and a molecular weight of 407.50 g/mol. Its IUPAC name is N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide.

Molecular Properties

Compound NameN-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide
PubChem CID169420485
Molecular FormulaC22H21N3O3S
Molecular Weight407.50 g/mol
Exact Mass407.13
IUPAC NameN-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide
SMILESCS(=O)(=O)Nc1ccc(-c2cccc(C(=O)Nc3ccccc3C3CC3)c2)cn1
InChIInChI=1S/C22H21N3O3S/c1-29(27,28)25-21-12-11-18(14-23-21)16-5-4-6-17(13-16)22(26)24-20-8-3-2-7-19(20)15-9-10-15/h2-8,11-15H,9-10H2,1H3,(H,23,25)(H,24,26)
InChIKeySVRWFAMVABBQTP-UHFFFAOYSA-N
XLogP4.25
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.50
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide 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-[5-(3-cyclopropylphenyl)-2-pyridinyl]pyrimidine-5-carboxamide
CID 129240170
N-[5-(3-cyclopropylphenyl)-2-pyridinyl]-6-methylpyridine-3-carboxamide
CID 129240179
2-chloro-N-[5-(3-cyclopropylphenyl)-2-pyridinyl]pyrimidine-5-carboxamide
CID 162697161
3-cyclopropyl-4-methoxy-N-(2-methylsulfonylphenyl)benzamide
CID 154754687
N-[3-(methanesulfonamido)phenyl]-3-phenylbenzamide
CID 169152254
N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide
CID 35368167
3-[2-(4-methoxyphenoxy)pyrimidin-5-yl]-N-(2-methylphenyl)benzamide
CID 53002812
3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide
CID 53116926
N-[2-(methanesulfonamido)phenyl]-1-methylpyrazole-4-carboxamide
CID 35368634
N-[5-(3-methoxyphenyl)-2-pyridinyl]pyridine-3-carboxamide
CID 157371621
N-[5-(3,4-dichlorophenyl)-2-pyridinyl]benzamide
CID 24949712
N-[2-(methanesulfonamido)phenyl]-3-methoxy-4-methylbenzamide
CID 35368704

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide?
The IUPAC name of N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide (CID 169420485) is N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide.
What is the SMILES notation for N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide?
The canonical SMILES for N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide is CS(=O)(=O)Nc1ccc(-c2cccc(C(=O)Nc3ccccc3C3CC3)c2)cn1.
What is the InChIKey of N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide?
The InChIKey is SVRWFAMVABBQTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3S/c1-29(27,28)25-21-12-11-18(14-23-21)16-5-4-6-17(13-16)22(26)24-20-8-3-2-7-19(20)15-9-10-15/h2-8,11-15H,9-10H2,1H3,(H,23,25)(H,24,26).
What are the key properties of N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide?
N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide has a molecular weight of 407.50 g/mol, XLogP of 4.25, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylphenyl)-3-[6-(methanesulfonamido)-3-pyridinyl]benzamide is sourced from PubChem (CID 169420485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).