N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide

C20H22N4O3S — CID 97216703

IUPACN-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide
SMILESC[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)Nc2cccc3nccn23)cc1
InChIInChI=1S/C20H22N4O3S/c1-15-5-2-3-13-24(15)28(26,27)17-10-8-16(9-11-17)20(25)22-19-7-4-6-18-21-12-14-23(18)19/h4,6-12,14-15H,2-3,5,13H2,1H3,(H,22,25)/t15-/m1/s1
InChIKeyYWFVXWQWLJDGOA-OAHLLOKOSA-N
MW398.49 g/mol
LogP3.15
Rot. Bonds4

About N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide

N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide (PubChem CID 97216703) has the molecular formula C20H22N4O3S and a molecular weight of 398.49 g/mol. Its IUPAC name is N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide.

Molecular Properties

Compound NameN-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide
PubChem CID97216703
Molecular FormulaC20H22N4O3S
Molecular Weight398.49 g/mol
Exact Mass398.14
IUPAC NameN-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide
SMILESC[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)Nc2cccc3nccn23)cc1
InChIInChI=1S/C20H22N4O3S/c1-15-5-2-3-13-24(15)28(26,27)17-10-8-16(9-11-17)20(25)22-19-7-4-6-18-21-12-14-23(18)19/h4,6-12,14-15H,2-3,5,13H2,1H3,(H,22,25)/t15-/m1/s1
InChIKeyYWFVXWQWLJDGOA-OAHLLOKOSA-N
XLogP3.15
TPSA83.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.49
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-methyl-1,3,4-oxadiazol-2-yl)-4-[(2S)-2-methylpiperidin-1-yl]sulfonylbenzamide
CID 2155664
N-(3-acetylphenyl)-4-[(2S)-2-methylpiperidin-1-yl]sulfonylbenzamide
CID 9095769
N-(2-benzylpyrazol-3-yl)-4-(2-methylpiperidin-1-yl)sulfonylbenzamide
CID 55359546
N'-[4-[(2S)-2-methylpiperidin-1-yl]sulfonylbenzoyl]pyridine-2-carbohydrazide
CID 9331872
4-(2-methylpiperidin-1-yl)sulfonyl-N-(5-methyl-2-pyridinyl)benzamide
CID 51274530
N-(4-chlorophenyl)-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide
CID 8762440
4-(2-methylpiperidin-1-yl)sulfonyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide
CID 55725981
N-(2-methoxyphenyl)-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide
CID 999491
4-(2-methylpiperidin-1-yl)sulfonyl-N-(2-phenylphenyl)benzamide
CID 112789629
4-(2-methylpiperidin-1-yl)sulfonyl-N-naphthalen-2-ylbenzamide
CID 3267062
4-[(2R)-2-methylpiperidin-1-yl]sulfonyl-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)benzamide
CID 7166838
4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-N-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)benzamide
CID 7166839

Frequently Asked Questions

What is the IUPAC name of N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide?
The IUPAC name of N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide (CID 97216703) is N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide.
What is the SMILES notation for N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide?
The canonical SMILES for N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide is C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)Nc2cccc3nccn23)cc1.
What is the InChIKey of N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide?
The InChIKey is YWFVXWQWLJDGOA-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H22N4O3S/c1-15-5-2-3-13-24(15)28(26,27)17-10-8-16(9-11-17)20(25)22-19-7-4-6-18-21-12-14-23(18)19/h4,6-12,14-15H,2-3,5,13H2,1H3,(H,22,25)/t15-/m1/s1.
What are the key properties of N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide?
N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide has a molecular weight of 398.49 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-imidazo[1,2-a]pyridin-5-yl-4-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzamide is sourced from PubChem (CID 97216703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).