N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C15H16N6O2 — CID 136528761

IUPACN-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(Nc1cc(C2CCOCC2)[nH]n1)c1cnn2cccnc12
InChIInChI=1S/C15H16N6O2/c22-15(11-9-17-21-5-1-4-16-14(11)21)18-13-8-12(19-20-13)10-2-6-23-7-3-10/h1,4-5,8-10H,2-3,6-7H2,(H2,18,19,20,22)
InChIKeyNMQHINWKIJWWBK-UHFFFAOYSA-N
MW312.33 g/mol
LogP1.60
Rot. Bonds3

About N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 136528761) has the molecular formula C15H16N6O2 and a molecular weight of 312.33 g/mol. Its IUPAC name is N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID136528761
Molecular FormulaC15H16N6O2
Molecular Weight312.33 g/mol
Exact Mass312.13
IUPAC NameN-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(Nc1cc(C2CCOCC2)[nH]n1)c1cnn2cccnc12
InChIInChI=1S/C15H16N6O2/c22-15(11-9-17-21-5-1-4-16-14(11)21)18-13-8-12(19-20-13)10-2-6-23-7-3-10/h1,4-5,8-10H,2-3,6-7H2,(H2,18,19,20,22)
InChIKeyNMQHINWKIJWWBK-UHFFFAOYSA-N
XLogP1.60
TPSA97.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-methyl-N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]-1-pentan-3-ylpyrazole-4-carboxamide
CID 75390413
N-(5-methyl-1,2-oxazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 1251288
N-(2,3,5,6-tetrafluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19414444
N-(5-chloro-2-morpholin-4-ylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 58056194
N-(2-hydroxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19414443
N-(3-methyl-2,3-dihydro-1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 142393172
N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 167973780
N-[(1R)-1-hydroxy-2,2-dimethyl-6-morpholin-4-yl-1,3-dihydroinden-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129284097
N-[6-morpholin-4-yl-1-oxo-2-(oxolan-3-ylmethyl)-3H-isoindol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 135354371
N-[4-formyl-5-[[methyl(oxan-4-yl)amino]methyl]-2-morpholin-4-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 129297773
N-[5-(5-chloro-2-methoxyphenyl)-1-(oxan-4-ylmethyl)pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 70497038
N-(1,1-dioxothietan-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 166255196

Frequently Asked Questions

What is the IUPAC name of N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 136528761) is N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is O=C(Nc1cc(C2CCOCC2)[nH]n1)c1cnn2cccnc12.
What is the InChIKey of N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is NMQHINWKIJWWBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O2/c22-15(11-9-17-21-5-1-4-16-14(11)21)18-13-8-12(19-20-13)10-2-6-23-7-3-10/h1,4-5,8-10H,2-3,6-7H2,(H2,18,19,20,22).
What are the key properties of N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 312.33 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(oxan-4-yl)-1H-pyrazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 136528761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).