(3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide

C19H24N2O4S — CID 100784037

IUPAC(3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide
SMILESCOc1ccc([C@@H](CC(=O)NCc2cccc(C)c2)NS(C)(=O)=O)cc1
InChIInChI=1S/C19H24N2O4S/c1-14-5-4-6-15(11-14)13-20-19(22)12-18(21-26(3,23)24)16-7-9-17(25-2)10-8-16/h4-11,18,21H,12-13H2,1-3H3,(H,20,22)/t18-/m1/s1
InChIKeyHDGVRLMRMNBMJN-GOSISDBHSA-N
MW376.48 g/mol
LogP2.30
Rot. Bonds8

About (3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide

(3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide (PubChem CID 100784037) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is (3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide.

Molecular Properties

Compound Name(3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide
PubChem CID100784037
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name(3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide
SMILESCOc1ccc([C@@H](CC(=O)NCc2cccc(C)c2)NS(C)(=O)=O)cc1
InChIInChI=1S/C19H24N2O4S/c1-14-5-4-6-15(11-14)13-20-19(22)12-18(21-26(3,23)24)16-7-9-17(25-2)10-8-16/h4-11,18,21H,12-13H2,1-3H3,(H,20,22)/t18-/m1/s1
InChIKeyHDGVRLMRMNBMJN-GOSISDBHSA-N
XLogP2.30
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-(3-methylphenyl)propanamide
CID 100784306
N-(furan-2-ylmethyl)-3-(methanesulfonamido)-3-(4-methoxyphenyl)propanamide
CID 133255406
3-(methanesulfonamido)-3-(4-methoxyphenyl)propanoic acid
CID 112509655
(3R)-N,N-dibenzyl-3-(methanesulfonamido)-3-(4-methoxyphenyl)propanamide
CID 100784499
(3S)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(1S)-1-(4-methoxyphenyl)ethyl]propanamide
CID 100784179
N-tert-butyl-3-(methanesulfonamido)-3-(4-methoxyphenyl)propanamide
CID 133241816
(3S)-N-(3,4-dimethylphenyl)-3-(methanesulfonamido)-3-(4-methoxyphenyl)propanamide
CID 100784326
3-(4-methoxy-N-methylsulfonylanilino)-N-[(3-methylphenyl)methyl]propanamide
CID 113144695
3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-(3-propan-2-yloxypropyl)propanamide
CID 133255472
(3R)-N-[(2R)-butan-2-yl]-3-(methanesulfonamido)-3-(4-methoxyphenyl)propanamide
CID 100784235
3-(4-methoxyphenyl)-N-[2-(3-methylphenyl)ethyl]butanamide
CID 110307646
N,N-diethyl-3-(methanesulfonamido)-3-(4-methoxyphenyl)propanamide
CID 133255458

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide?
The IUPAC name of (3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide (CID 100784037) is (3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide.
What is the SMILES notation for (3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide?
The canonical SMILES for (3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide is COc1ccc([C@@H](CC(=O)NCc2cccc(C)c2)NS(C)(=O)=O)cc1.
What is the InChIKey of (3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide?
The InChIKey is HDGVRLMRMNBMJN-GOSISDBHSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-14-5-4-6-15(11-14)13-20-19(22)12-18(21-26(3,23)24)16-7-9-17(25-2)10-8-16/h4-11,18,21H,12-13H2,1-3H3,(H,20,22)/t18-/m1/s1.
What are the key properties of (3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide?
(3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide has a molecular weight of 376.48 g/mol, XLogP of 2.30, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(methanesulfonamido)-3-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]propanamide is sourced from PubChem (CID 100784037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).