3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide

C16H19N5O4S — CID 110416152

IUPAC3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide
SMILESCc1noc(C)c1S(=O)(=O)NCCC(=O)NCc1ncc2ccccn12
InChIInChI=1S/C16H19N5O4S/c1-11-16(12(2)25-20-11)26(23,24)19-7-6-15(22)18-10-14-17-9-13-5-3-4-8-21(13)14/h3-5,8-9,19H,6-7,10H2,1-2H3,(H,18,22)
InChIKeyFINHQUGBNJTLDN-UHFFFAOYSA-N
MW377.43 g/mol
LogP0.92
Rot. Bonds7

About 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide

3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide (PubChem CID 110416152) has the molecular formula C16H19N5O4S and a molecular weight of 377.43 g/mol. Its IUPAC name is 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide
PubChem CID110416152
Molecular FormulaC16H19N5O4S
Molecular Weight377.43 g/mol
Exact Mass377.12
IUPAC Name3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide
SMILESCc1noc(C)c1S(=O)(=O)NCCC(=O)NCc1ncc2ccccn12
InChIInChI=1S/C16H19N5O4S/c1-11-16(12(2)25-20-11)26(23,24)19-7-6-15(22)18-10-14-17-9-13-5-3-4-8-21(13)14/h3-5,8-9,19H,6-7,10H2,1-2H3,(H,18,22)
InChIKeyFINHQUGBNJTLDN-UHFFFAOYSA-N
XLogP0.92
TPSA118.60 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.43
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide
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3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-[(1S)-1-phenylethyl]propanamide
CID 9032989
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N-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]ethyl]-2-(2-ethoxyphenoxy)acetamide
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N-[2-(4-chlorophenyl)sulfanylethyl]-3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanamide
CID 9259359
3,5-dimethyl-N-[2-(2-oxo-1-pyridinyl)ethyl]-1,2-oxazole-4-sulfonamide
CID 75512081
N-(3-chlorophenyl)-3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanamide
CID 9042417
N-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]ethyl]propanamide
CID 108574106
N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide?
The IUPAC name of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide (CID 110416152) is 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide.
What is the SMILES notation for 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide?
The canonical SMILES for 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide is Cc1noc(C)c1S(=O)(=O)NCCC(=O)NCc1ncc2ccccn12.
What is the InChIKey of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide?
The InChIKey is FINHQUGBNJTLDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O4S/c1-11-16(12(2)25-20-11)26(23,24)19-7-6-15(22)18-10-14-17-9-13-5-3-4-8-21(13)14/h3-5,8-9,19H,6-7,10H2,1-2H3,(H,18,22).
What are the key properties of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide?
3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide has a molecular weight of 377.43 g/mol, XLogP of 0.92, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)propanamide is sourced from PubChem (CID 110416152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).