N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C18H14ClN5O3 — CID 58056335

About N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 58056335) has the molecular formula C18H14ClN5O3 and a molecular weight of 383.80 g/mol. Its IUPAC name is N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

• Compound Name: N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
• PubChem CID: 58056335
• Molecular Formula: C18H14ClN5O3
• Molecular Weight: 383.80 g/mol
• Exact Mass: 383.08
• IUPAC Name: N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
• SMILES: Cc1ncoc1COc1ccc(Cl)cc1NC(=O)c1cnn2cccnc12
• InChI: InChI=1S/C18H14ClN5O3/c1-11-16(27-10-21-11)9-26-15-4-3-12(19)7-14(15)23-18(25)13-8-22-24-6-2-5-20-17(13)24/h2-8,10H,9H2,1H3,(H,23,25)
• InChIKey: WFDFLYWGHMUJFE-UHFFFAOYSA-N
• XLogP: 3.51
• TPSA: 94.55 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	383.80
LogP ≤ 5	3.51
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The IUPAC name of N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 58056335) is N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

What is the SMILES notation for N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The canonical SMILES for N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1ncoc1COc1ccc(Cl)cc1NC(=O)c1cnn2cccnc12.

What is the InChIKey of N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The InChIKey is WFDFLYWGHMUJFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClN5O3/c1-11-16(27-10-21-11)9-26-15-4-3-12(19)7-14(15)23-18(25)13-8-22-24-6-2-5-20-17(13)24/h2-8,10H,9H2,1H3,(H,23,25).

What are the key properties of N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 383.80 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-chloro-2-[(4-methyl-1,3-oxazol-5-yl)methoxy]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 58056335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).