N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide

C20H23N5O3 — CID 164606049

IUPACN-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
SMILESCc1onc(OCC2CC(N)C2)c1-c1ccn2nc(NC(=O)C3CC3)cc2c1
InChIInChI=1S/C20H23N5O3/c1-11-18(20(24-28-11)27-10-12-6-15(21)7-12)14-4-5-25-16(8-14)9-17(23-25)22-19(26)13-2-3-13/h4-5,8-9,12-13,15H,2-3,6-7,10,21H2,1H3,(H,22,23,26)
InChIKeyGRYZLFIEQLJSBW-UHFFFAOYSA-N
MW381.44 g/mol
LogP2.76
Rot. Bonds6

About N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide

N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide (PubChem CID 164606049) has the molecular formula C20H23N5O3 and a molecular weight of 381.44 g/mol. Its IUPAC name is N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
PubChem CID164606049
Molecular FormulaC20H23N5O3
Molecular Weight381.44 g/mol
Exact Mass381.18
IUPAC NameN-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
SMILESCc1onc(OCC2CC(N)C2)c1-c1ccn2nc(NC(=O)C3CC3)cc2c1
InChIInChI=1S/C20H23N5O3/c1-11-18(20(24-28-11)27-10-12-6-15(21)7-12)14-4-5-25-16(8-14)9-17(23-25)22-19(26)13-2-3-13/h4-5,8-9,12-13,15H,2-3,6-7,10,21H2,1H3,(H,22,23,26)
InChIKeyGRYZLFIEQLJSBW-UHFFFAOYSA-N
XLogP2.76
TPSA107.68 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.44
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
The IUPAC name of N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide (CID 164606049) is N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide is Cc1onc(OCC2CC(N)C2)c1-c1ccn2nc(NC(=O)C3CC3)cc2c1.
What is the InChIKey of N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
The InChIKey is GRYZLFIEQLJSBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O3/c1-11-18(20(24-28-11)27-10-12-6-15(21)7-12)14-4-5-25-16(8-14)9-17(23-25)22-19(26)13-2-3-13/h4-5,8-9,12-13,15H,2-3,6-7,10,21H2,1H3,(H,22,23,26).
What are the key properties of N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide has a molecular weight of 381.44 g/mol, XLogP of 2.76, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[3-[(3-aminocyclobutyl)methoxy]-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide is sourced from PubChem (CID 164606049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).