6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C15H19N5O2 — CID 50983427

IUPAC6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cnc2c(C(=O)NCC3CC(C(C)C)=NO3)cnn2c1
InChIInChI=1S/C15H19N5O2/c1-9(2)13-4-11(22-19-13)6-17-15(21)12-7-18-20-8-10(3)5-16-14(12)20/h5,7-9,11H,4,6H2,1-3H3,(H,17,21)
InChIKeyTZOIEKSYFYQHBL-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.57
Rot. Bonds4

About 6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 50983427) has the molecular formula C15H19N5O2 and a molecular weight of 301.35 g/mol. Its IUPAC name is 6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID50983427
Molecular FormulaC15H19N5O2
Molecular Weight301.35 g/mol
Exact Mass301.15
IUPAC Name6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cnc2c(C(=O)NCC3CC(C(C)C)=NO3)cnn2c1
InChIInChI=1S/C15H19N5O2/c1-9(2)13-4-11(22-19-13)6-17-15(21)12-7-18-20-8-10(3)5-16-14(12)20/h5,7-9,11H,4,6H2,1-3H3,(H,17,21)
InChIKeyTZOIEKSYFYQHBL-UHFFFAOYSA-N
XLogP1.57
TPSA80.88 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 50983427) is 6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cnc2c(C(=O)NCC3CC(C(C)C)=NO3)cnn2c1.
What is the InChIKey of 6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is TZOIEKSYFYQHBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2/c1-9(2)13-4-11(22-19-13)6-17-15(21)12-7-18-20-8-10(3)5-16-14(12)20/h5,7-9,11H,4,6H2,1-3H3,(H,17,21).
What are the key properties of 6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 301.35 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 50983427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).