2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide

C20H22N4O — CID 155529317

IUPAC2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide
SMILESO=C(CC1CCCCC1)Nc1nn2cccnc2c1-c1ccccc1
InChIInChI=1S/C20H22N4O/c25-17(14-15-8-3-1-4-9-15)22-19-18(16-10-5-2-6-11-16)20-21-12-7-13-24(20)23-19/h2,5-7,10-13,15H,1,3-4,8-9,14H2,(H,22,23,25)
InChIKeyPMRYWWPMSHYSCZ-UHFFFAOYSA-N
MW334.42 g/mol
LogP4.31
Rot. Bonds4

About 2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide

2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide (PubChem CID 155529317) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide.

Molecular Properties

Compound Name2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide
PubChem CID155529317
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide
SMILESO=C(CC1CCCCC1)Nc1nn2cccnc2c1-c1ccccc1
InChIInChI=1S/C20H22N4O/c25-17(14-15-8-3-1-4-9-15)22-19-18(16-10-5-2-6-11-16)20-21-12-7-13-24(20)23-19/h2,5-7,10-13,15H,1,3-4,8-9,14H2,(H,22,23,25)
InChIKeyPMRYWWPMSHYSCZ-UHFFFAOYSA-N
XLogP4.31
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-3-benzyl-3-methyl-5-[5-(2-methylpyrimidin-5-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-1H-indol-2-one
CID 145946114
4-{3-Phenylpyrazolo[1,5-a]pyrimidin-6-yl}-1-[3-(piperidin-1-yl)propyl]-1,2-dihydropyridin-2-one
CID 5329469
1-[3-(4-Methylpiperazin-1-yl)propyl]-4-{3-phenylpyrazolo[1,5-a]pyrimidin-6-yl}-1,2-dihydropyridin-2-one
CID 5329470
Pyrazolopyridine deriv. 9
CID 6539533
N-(5-phenyl-2H-pyrazolo[3,4-b]pyridin-3-yl)butanamide
CID 6539535
N-[5-(2-fluorophenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]butanamide
CID 6539542
N-(5-Pyridin-3-yl-1H-pyrazolo[3,4-b]pyridin-3-yl)butyramide
CID 6539546
BS-181
CID 49867929
4-[4-[3-Bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]benzamide
CID 137348547
4-(5-((Pyridin-3-ylmethyl)amino)pyrazolo[1,5-a]pyrimidin-3-yl)benzamide
CID 145994823
N-[4-[2-(2-cyanoanilino)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]-2-(4-fluorophenyl)acetamide
CID 53234586
Mps-BAY1
CID 53234663

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide?
The IUPAC name of 2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide (CID 155529317) is 2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide.
What is the SMILES notation for 2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide?
The canonical SMILES for 2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide is O=C(CC1CCCCC1)Nc1nn2cccnc2c1-c1ccccc1.
What is the InChIKey of 2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide?
The InChIKey is PMRYWWPMSHYSCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c25-17(14-15-8-3-1-4-9-15)22-19-18(16-10-5-2-6-11-16)20-21-12-7-13-24(20)23-19/h2,5-7,10-13,15H,1,3-4,8-9,14H2,(H,22,23,25).
What are the key properties of 2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide?
2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide has a molecular weight of 334.42 g/mol, XLogP of 4.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-(3-phenylpyrazolo[1,5-a]pyrimidin-2-yl)acetamide is sourced from PubChem (CID 155529317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).