1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide

C20H22N4O — CID 56573417

IUPAC1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide
SMILESCC(C)(C)c1ccc(C2(C(=O)Nc3ccnc4ccnn34)CC2)cc1
InChIInChI=1S/C20H22N4O/c1-19(2,3)14-4-6-15(7-5-14)20(10-11-20)18(25)23-17-8-12-21-16-9-13-22-24(16)17/h4-9,12-13H,10-11H2,1-3H3,(H,23,25)
InChIKeyBLTWOZWIQRGLJU-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.70
Rot. Bonds3

About 1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide

1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide (PubChem CID 56573417) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide
PubChem CID56573417
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide
SMILESCC(C)(C)c1ccc(C2(C(=O)Nc3ccnc4ccnn34)CC2)cc1
InChIInChI=1S/C20H22N4O/c1-19(2,3)14-4-6-15(7-5-14)20(10-11-20)18(25)23-17-8-12-21-16-9-13-22-24(16)17/h4-9,12-13H,10-11H2,1-3H3,(H,23,25)
InChIKeyBLTWOZWIQRGLJU-UHFFFAOYSA-N
XLogP3.70
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-tert-butylphenyl)-N-(4-methyl-2-pyridinyl)cyclopropane-1-carboxamide
CID 52723771
1-(2-ethoxyethyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopentane-1-carboxamide
CID 75382037
1-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]-3-pyrazolo[1,5-a]pyrimidin-7-ylurea
CID 138053886
1-(4-tert-butylphenyl)-N-[3-(1-methylimidazol-2-yl)phenyl]cyclopropane-1-carboxamide
CID 71938322
N-(2-methylpyrazol-3-yl)-1-phenylcyclobutane-1-carboxamide
CID 110473533
1-(4-tert-butylphenyl)-N-[4-(2,5-dioxopyrrolidin-1-yl)-3-methylphenyl]cyclopropane-1-carboxamide
CID 86941652
N-pyrazolo[1,5-a]pyrimidin-7-ylthiophene-3-carboxamide
CID 146121640
1-(4-tert-butylphenyl)-N-[2-chloro-5-(propanoylamino)phenyl]cyclopropane-1-carboxamide
CID 55799431
1-(4-tert-butylphenyl)-N-[2-(furan-2-yl)ethyl]cyclopropane-1-carboxamide
CID 55606445
1-(4-tert-butylphenyl)-N-[5-(dimethylsulfamoyl)-2-methylphenyl]cyclopropane-1-carboxamide
CID 46686248
1-(4-tert-butylphenyl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclopropane-1-carboxamide
CID 49332395
1-(4-tert-butylphenyl)-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)cyclopropane-1-carboxamide
CID 39215283

Frequently Asked Questions

What is the IUPAC name of 1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide?
The IUPAC name of 1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide (CID 56573417) is 1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide.
What is the SMILES notation for 1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide?
The canonical SMILES for 1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide is CC(C)(C)c1ccc(C2(C(=O)Nc3ccnc4ccnn34)CC2)cc1.
What is the InChIKey of 1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide?
The InChIKey is BLTWOZWIQRGLJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-19(2,3)14-4-6-15(7-5-14)20(10-11-20)18(25)23-17-8-12-21-16-9-13-22-24(16)17/h4-9,12-13H,10-11H2,1-3H3,(H,23,25).
What are the key properties of 1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide?
1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide has a molecular weight of 334.42 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-tert-butylphenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylcyclopropane-1-carboxamide is sourced from PubChem (CID 56573417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).