N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

C14H18N4O2 — CID 16734509

IUPACN-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(=O)n2[nH]cc(C(=O)NC3CCCCC3)c2n1
InChIInChI=1S/C14H18N4O2/c1-9-7-12(19)18-13(16-9)11(8-15-18)14(20)17-10-5-3-2-4-6-10/h7-8,10,15H,2-6H2,1H3,(H,17,20)
InChIKeyLKAPEDOXLUQTSS-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.39
Rot. Bonds2

About N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 16734509) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID16734509
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC NameN-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(=O)n2[nH]cc(C(=O)NC3CCCCC3)c2n1
InChIInChI=1S/C14H18N4O2/c1-9-7-12(19)18-13(16-9)11(8-15-18)14(20)17-10-5-3-2-4-6-10/h7-8,10,15H,2-6H2,1H3,(H,17,20)
InChIKeyLKAPEDOXLUQTSS-UHFFFAOYSA-N
XLogP1.39
TPSA79.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-ethoxypropyl)-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 4134667
N-cyclohexyl-5-methyl-7-oxo-6-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 5120256
7-Hydroxy-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 110485760
6-chloro-5-methyl-N-(4-methylcyclohexyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 3390609
N-[(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]acetamide
CID 121371083
N-[(2,5-dimethyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]acetamide
CID 121371102
2-methyl-N-[(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]propanamide
CID 129034348
N-[(2,5-dimethyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]propanamide
CID 129034354
N-[(2,5-dimethyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]-2-methylpropanamide
CID 129034355
N-[(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)methyl]propanamide
CID 134314264
3-ethyl-2-methyl-5-(2-oxo-1H-pyridin-3-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 46958599
3-(azepane-1-carbonyl)-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 50926753

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 16734509) is N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cc(=O)n2[nH]cc(C(=O)NC3CCCCC3)c2n1.
What is the InChIKey of N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is LKAPEDOXLUQTSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-9-7-12(19)18-13(16-9)11(8-15-18)14(20)17-10-5-3-2-4-6-10/h7-8,10,15H,2-6H2,1H3,(H,17,20).
What are the key properties of N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 1.39, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 16734509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).