6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

C21H19N5O2S — CID 78876383

IUPAC6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCC(C)c1noc2nc(C3CC3)cc(C(=O)Nc3nc(-c4ccccn4)cs3)c12
InChIInChI=1S/C21H19N5O2S/c1-11(2)18-17-13(9-15(12-6-7-12)23-20(17)28-26-18)19(27)25-21-24-16(10-29-21)14-5-3-4-8-22-14/h3-5,8-12H,6-7H2,1-2H3,(H,24,25,27)
InChIKeyPNVWESCTPZGHAA-UHFFFAOYSA-N
MW405.48 g/mol
LogP4.99
Rot. Bonds5

About 6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 78876383) has the molecular formula C21H19N5O2S and a molecular weight of 405.48 g/mol. Its IUPAC name is 6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
PubChem CID78876383
Molecular FormulaC21H19N5O2S
Molecular Weight405.48 g/mol
Exact Mass405.13
IUPAC Name6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCC(C)c1noc2nc(C3CC3)cc(C(=O)Nc3nc(-c4ccccn4)cs3)c12
InChIInChI=1S/C21H19N5O2S/c1-11(2)18-17-13(9-15(12-6-7-12)23-20(17)28-26-18)19(27)25-21-24-16(10-29-21)14-5-3-4-8-22-14/h3-5,8-12H,6-7H2,1-2H3,(H,24,25,27)
InChIKeyPNVWESCTPZGHAA-UHFFFAOYSA-N
XLogP4.99
TPSA93.80 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.48
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide with MolForge

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Related Compounds

6-cyclopropyl-N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 55718593
6-cyclopropyl-N-(1-hydroxypropan-2-yl)-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 78875339
N-[(2S)-1-aminopropan-2-yl]-6-cyclopropyl-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 120504755
(2R)-2-[(6-cyclopropyl-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carbonyl)amino]-3-methylbutanoic acid
CID 119368348
N-(2-amino-2-methylpropyl)-6-cyclopropyl-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride
CID 119627996
N-[(2S)-1-aminopropan-2-yl]-6-cyclopropyl-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride
CID 120504754
6-cyclopropyl-N-(1-hydroxybutan-2-yl)-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 110891714
5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-3-carboxamide
CID 2462544
6-cyclopropyl-N-[(4-methylquinazolin-2-yl)methyl]-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 71880326
methyl (2R)-2-[(6-cyclopropyl-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carbonyl)amino]-2-(3-hydroxyphenyl)acetate
CID 97251352
6-cyclopropyl-N-(3-hydroxypropyl)-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 78876018
N-(6-amino-1,3-benzodioxol-5-yl)-6-cyclopropyl-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 119618461

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (CID 78876383) is 6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is CC(C)c1noc2nc(C3CC3)cc(C(=O)Nc3nc(-c4ccccn4)cs3)c12.
What is the InChIKey of 6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is PNVWESCTPZGHAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2S/c1-11(2)18-17-13(9-15(12-6-7-12)23-20(17)28-26-18)19(27)25-21-24-16(10-29-21)14-5-3-4-8-22-14/h3-5,8-12H,6-7H2,1-2H3,(H,24,25,27).
What are the key properties of 6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 405.48 g/mol, XLogP of 4.99, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3-propan-2-yl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 78876383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).