N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

C14H16N6O — CID 56756107

IUPACN-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1cc(CC(C)NC(=O)c2cc3ncccn3n2)n[nH]1
InChIInChI=1S/C14H16N6O/c1-9(6-11-7-10(2)17-18-11)16-14(21)12-8-13-15-4-3-5-20(13)19-12/h3-5,7-9H,6H2,1-2H3,(H,16,21)(H,17,18)
InChIKeyJUQRQEOQVZGMRT-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.12
Rot. Bonds4

About N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 56756107) has the molecular formula C14H16N6O and a molecular weight of 284.32 g/mol. Its IUPAC name is N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID56756107
Molecular FormulaC14H16N6O
Molecular Weight284.32 g/mol
Exact Mass284.14
IUPAC NameN-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1cc(CC(C)NC(=O)c2cc3ncccn3n2)n[nH]1
InChIInChI=1S/C14H16N6O/c1-9(6-11-7-10(2)17-18-11)16-14(21)12-8-13-15-4-3-5-20(13)19-12/h3-5,7-9H,6H2,1-2H3,(H,16,21)(H,17,18)
InChIKeyJUQRQEOQVZGMRT-UHFFFAOYSA-N
XLogP1.12
TPSA87.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 56756107) is N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide is Cc1cc(CC(C)NC(=O)c2cc3ncccn3n2)n[nH]1.
What is the InChIKey of N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is JUQRQEOQVZGMRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6O/c1-9(6-11-7-10(2)17-18-11)16-14(21)12-8-13-15-4-3-5-20(13)19-12/h3-5,7-9H,6H2,1-2H3,(H,16,21)(H,17,18).
What are the key properties of N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 56756107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).