4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide

C18H23N3O3S — CID 125160684

IUPAC4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide
SMILESCCS(=O)(=O)Nc1ccc(C(=O)N[C@H](C)Cc2cccc(C)n2)cc1
InChIInChI=1S/C18H23N3O3S/c1-4-25(23,24)21-16-10-8-15(9-11-16)18(22)20-14(3)12-17-7-5-6-13(2)19-17/h5-11,14,21H,4,12H2,1-3H3,(H,20,22)/t14-/m1/s1
InChIKeyZGHIPLPJWRAKQW-CQSZACIVSA-N
MW361.47 g/mol
LogP2.51
Rot. Bonds7

About 4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide

4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide (PubChem CID 125160684) has the molecular formula C18H23N3O3S and a molecular weight of 361.47 g/mol. Its IUPAC name is 4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide.

Molecular Properties

Compound Name4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide
PubChem CID125160684
Molecular FormulaC18H23N3O3S
Molecular Weight361.47 g/mol
Exact Mass361.15
IUPAC Name4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide
SMILESCCS(=O)(=O)Nc1ccc(C(=O)N[C@H](C)Cc2cccc(C)n2)cc1
InChIInChI=1S/C18H23N3O3S/c1-4-25(23,24)21-16-10-8-15(9-11-16)18(22)20-14(3)12-17-7-5-6-13(2)19-17/h5-11,14,21H,4,12H2,1-3H3,(H,20,22)/t14-/m1/s1
InChIKeyZGHIPLPJWRAKQW-CQSZACIVSA-N
XLogP2.51
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.47
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3,6-dimethylpyrazin-2-yl)-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide
CID 119066256
4-(ethylsulfonylamino)-N-[1-(6-methyl-3-pyridinyl)ethyl]benzamide
CID 135120365
3-methoxy-5-[[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]carbamoyl]benzoic acid
CID 126431758
3-(methanesulfonamido)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]propanamide
CID 125171127
4-(ethylsulfonylamino)-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 94027949
1,6-dimethyl-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]-4-oxopyridine-2-carboxamide
CID 125161516
4,4,4-trifluoro-N-[1-(6-methyl-2-pyridinyl)propan-2-yl]butanamide
CID 91837939
4-(ethylsulfonylamino)-N-(3-methylphenyl)benzamide
CID 2996698
N-methyl-1-(6-methyl-2-pyridinyl)propan-2-amine
CID 16640577
5-(methoxymethyl)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]furan-2-carboxamide
CID 124751971
N-[1-[3-[4-(ethylsulfonylamino)phenyl]-1,2,4-oxadiazol-5-yl]ethyl]benzamide
CID 20972370
N-[(2R)-butan-2-yl]-6-[4-(ethylsulfonylamino)phenyl]sulfanylpyridine-3-carboxamide
CID 92883059

Frequently Asked Questions

What is the IUPAC name of 4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide?
The IUPAC name of 4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide (CID 125160684) is 4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide.
What is the SMILES notation for 4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide?
The canonical SMILES for 4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide is CCS(=O)(=O)Nc1ccc(C(=O)N[C@H](C)Cc2cccc(C)n2)cc1.
What is the InChIKey of 4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide?
The InChIKey is ZGHIPLPJWRAKQW-CQSZACIVSA-N. The full InChI is InChI=1S/C18H23N3O3S/c1-4-25(23,24)21-16-10-8-15(9-11-16)18(22)20-14(3)12-17-7-5-6-13(2)19-17/h5-11,14,21H,4,12H2,1-3H3,(H,20,22)/t14-/m1/s1.
What are the key properties of 4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide?
4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide has a molecular weight of 361.47 g/mol, XLogP of 2.51, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylsulfonylamino)-N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]benzamide is sourced from PubChem (CID 125160684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).