7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide

C15H18N6O3 — CID 125169096

IUPAC7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCc1c(C(=O)N[C@@H](C)c2nc(C(C)C)no2)cnc2cc(=O)[nH]n12
InChIInChI=1S/C15H18N6O3/c1-7(2)13-18-15(24-20-13)8(3)17-14(23)10-6-16-11-5-12(22)19-21(11)9(10)4/h5-8H,1-4H3,(H,17,23)(H,19,22)/t8-/m0/s1
InChIKeyLVTRJVISEKHADY-QMMMGPOBSA-N
MW330.35 g/mol
LogP1.33
Rot. Bonds4

About 7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide

7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide (PubChem CID 125169096) has the molecular formula C15H18N6O3 and a molecular weight of 330.35 g/mol. Its IUPAC name is 7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide
PubChem CID125169096
Molecular FormulaC15H18N6O3
Molecular Weight330.35 g/mol
Exact Mass330.14
IUPAC Name7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCc1c(C(=O)N[C@@H](C)c2nc(C(C)C)no2)cnc2cc(=O)[nH]n12
InChIInChI=1S/C15H18N6O3/c1-7(2)13-18-15(24-20-13)8(3)17-14(23)10-6-16-11-5-12(22)19-21(11)9(10)4/h5-8H,1-4H3,(H,17,23)(H,19,22)/t8-/m0/s1
InChIKeyLVTRJVISEKHADY-QMMMGPOBSA-N
XLogP1.33
TPSA118.18 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.35
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide with MolForge

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Related Compounds

7-methyl-2-oxo-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid
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Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide?
The IUPAC name of 7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide (CID 125169096) is 7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide?
The canonical SMILES for 7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide is Cc1c(C(=O)N[C@@H](C)c2nc(C(C)C)no2)cnc2cc(=O)[nH]n12.
What is the InChIKey of 7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide?
The InChIKey is LVTRJVISEKHADY-QMMMGPOBSA-N. The full InChI is InChI=1S/C15H18N6O3/c1-7(2)13-18-15(24-20-13)8(3)17-14(23)10-6-16-11-5-12(22)19-21(11)9(10)4/h5-8H,1-4H3,(H,17,23)(H,19,22)/t8-/m0/s1.
What are the key properties of 7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide?
7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide has a molecular weight of 330.35 g/mol, XLogP of 1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-oxo-N-[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 125169096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).