6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

C18H23N5O3 — CID 134801797

IUPAC6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCNC(=O)c1cc(C2CC2)nc2onc(C3CCCN3C(=O)N(C)C)c12
InChIInChI=1S/C18H23N5O3/c1-19-16(24)11-9-12(10-6-7-10)20-17-14(11)15(21-26-17)13-5-4-8-23(13)18(25)22(2)3/h9-10,13H,4-8H2,1-3H3,(H,19,24)
InChIKeyPUZFGIXQXKOTDS-UHFFFAOYSA-N
MW357.41 g/mol
LogP2.28
Rot. Bonds3

About 6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 134801797) has the molecular formula C18H23N5O3 and a molecular weight of 357.41 g/mol. Its IUPAC name is 6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
PubChem CID134801797
Molecular FormulaC18H23N5O3
Molecular Weight357.41 g/mol
Exact Mass357.18
IUPAC Name6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCNC(=O)c1cc(C2CC2)nc2onc(C3CCCN3C(=O)N(C)C)c12
InChIInChI=1S/C18H23N5O3/c1-19-16(24)11-9-12(10-6-7-10)20-17-14(11)15(21-26-17)13-5-4-8-23(13)18(25)22(2)3/h9-10,13H,4-8H2,1-3H3,(H,19,24)
InChIKeyPUZFGIXQXKOTDS-UHFFFAOYSA-N
XLogP2.28
TPSA91.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-cyclopropyl-3-[1-(dimethylcarbamoyl)piperidin-4-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 134802045
3-(1-benzoylpyrrolidin-2-yl)-6-cyclopropyl-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 134802431
6-cyclopropyl-N-methyl-3-[1-(morpholine-4-carbonyl)pyrrolidin-3-yl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 134802014
3-[1-(4-chlorobenzoyl)piperidin-4-yl]-6-cyclopropyl-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 134801159
3-[1-(3-chlorobenzoyl)piperidin-3-yl]-6-cyclopropyl-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 134802019
6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-3-yl]-N,1-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 134803718
6-cyclopropyl-3-[1-(2-methoxybenzoyl)pyrrolidin-3-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 134802011
3-[1-[2-(3-chlorophenyl)acetyl]pyrrolidin-3-yl]-6-cyclopropyl-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 134802466
3-[1-(cyclohexanecarbonyl)piperidin-3-yl]-N,6-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 134803876
3-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N,6-dimethyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 134802983
3,6-dicyclopropyl-N-[2-(4-methylpyrazol-1-yl)ethyl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 171315129
6-cyclopropyl-3-phenyl-N-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 171315419

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (CID 134801797) is 6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is CNC(=O)c1cc(C2CC2)nc2onc(C3CCCN3C(=O)N(C)C)c12.
What is the InChIKey of 6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is PUZFGIXQXKOTDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O3/c1-19-16(24)11-9-12(10-6-7-10)20-17-14(11)15(21-26-17)13-5-4-8-23(13)18(25)22(2)3/h9-10,13H,4-8H2,1-3H3,(H,19,24).
What are the key properties of 6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 357.41 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3-[1-(dimethylcarbamoyl)pyrrolidin-2-yl]-N-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 134801797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).