N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide

C13H18N4O2 — CID 126834527

IUPACN-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCC(C)C(CCO)NC(=O)c1ccn2nccc2n1
InChIInChI=1S/C13H18N4O2/c1-9(2)10(5-8-18)16-13(19)11-4-7-17-12(15-11)3-6-14-17/h3-4,6-7,9-10,18H,5,8H2,1-2H3,(H,16,19)
InChIKeyCVCPQUBHWZFBQD-UHFFFAOYSA-N
MW262.31 g/mol
LogP0.87
Rot. Bonds5

About N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide

N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 126834527) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID126834527
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC NameN-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCC(C)C(CCO)NC(=O)c1ccn2nccc2n1
InChIInChI=1S/C13H18N4O2/c1-9(2)10(5-8-18)16-13(19)11-4-7-17-12(15-11)3-6-14-17/h3-4,6-7,9-10,18H,5,8H2,1-2H3,(H,16,19)
InChIKeyCVCPQUBHWZFBQD-UHFFFAOYSA-N
XLogP0.87
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-hydroxy-4-methylpentan-3-yl)-2-methyl-1,3-thiazole-4-carboxamide
CID 103750834
5-chloro-N-(1-hydroxy-4-methylpentan-3-yl)pyridine-2-carboxamide
CID 103782372
N-(1-hydroxy-4-methylpentan-3-yl)pyridine-3-carboxamide
CID 103751046
3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol
CID 115372691
N-(1-hydroxy-4-methylpentan-3-yl)-1-benzofuran-2-carboxamide
CID 103751093
N-(1-hydroxy-4-methylpentan-3-yl)-2-pyrazol-1-ylacetamide
CID 103782364
N-propan-2-yl-2-(pyrazolo[1,5-a]pyrimidin-5-ylamino)acetamide
CID 113296656
2,6-dichloro-N-(1-hydroxy-4-methylpentan-3-yl)benzamide
CID 103782454
N-(1-bromo-4-methylpentan-3-yl)-6-methylpyridine-2-carboxamide
CID 106355356
N-(1-hydroxy-4-methylpentan-3-yl)-2-pyridin-4-ylbenzamide
CID 126834520
1-(1-hydroxy-4-methylpentan-3-yl)-3-[4-(1-methylpyrrol-2-yl)butan-2-yl]urea
CID 111508276
1-(1-hydroxy-4-methylpentan-3-yl)-3-[2-(4-pyrazol-1-ylphenyl)ethyl]urea
CID 111504349

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide (CID 126834527) is N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide is CC(C)C(CCO)NC(=O)c1ccn2nccc2n1.
What is the InChIKey of N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is CVCPQUBHWZFBQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c1-9(2)10(5-8-18)16-13(19)11-4-7-17-12(15-11)3-6-14-17/h3-4,6-7,9-10,18H,5,8H2,1-2H3,(H,16,19).
What are the key properties of N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide?
N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 0.87, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 126834527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).