N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C25H24N6O2 — CID 141316907

IUPACN-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(NC(=O)c2cnn3cccnc23)c(N2CCCCC2)c1
InChIInChI=1S/C25H24N6O2/c32-24(28-19-8-3-1-4-9-19)18-10-11-21(22(16-18)30-13-5-2-6-14-30)29-25(33)20-17-27-31-15-7-12-26-23(20)31/h1,3-4,7-12,15-17H,2,5-6,13-14H2,(H,28,32)(H,29,33)
InChIKeyUQUKPMGMQJIHGD-UHFFFAOYSA-N
MW440.51 g/mol
LogP4.22
Rot. Bonds5

About N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 141316907) has the molecular formula C25H24N6O2 and a molecular weight of 440.51 g/mol. Its IUPAC name is N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID141316907
Molecular FormulaC25H24N6O2
Molecular Weight440.51 g/mol
Exact Mass440.20
IUPAC NameN-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(NC(=O)c2cnn3cccnc23)c(N2CCCCC2)c1
InChIInChI=1S/C25H24N6O2/c32-24(28-19-8-3-1-4-9-19)18-10-11-21(22(16-18)30-13-5-2-6-14-30)29-25(33)20-17-27-31-15-7-12-26-23(20)31/h1,3-4,7-12,15-17H,2,5-6,13-14H2,(H,28,32)(H,29,33)
InChIKeyUQUKPMGMQJIHGD-UHFFFAOYSA-N
XLogP4.22
TPSA91.63 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.51
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-chloro-2-pyrrolidin-1-ylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 58056141
N-(4-acetylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 1256529
N-[2-(azepan-1-yl)-5-ethyl-4-(hydroxymethoxy)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;ethane
CID 145338731
N-(2-hydroxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19414443
N-(2-methyl-6-pyrrolidin-1-yl-2,3-dihydro-1-benzofuran-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 145338503
N-(3-acetylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 4151653
N-(2-phenylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 58056308
tert-butyl N-[[5-(phenylcarbamoyl)-2-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)phenyl]-piperidin-4-ylmethyl]carbamate
CID 66665116
N-(5-chloro-2-morpholin-4-ylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 58056194
dimethyl 5-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)benzene-1,3-dicarboxylate
CID 5112652
N-(2-nitrophenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19414583
2-(6-azaspiro[2.5]octan-6-yl)-4-iodo-N-pyrazolo[1,5-a]pyrimidin-3-ylbenzamide
CID 172559550

Frequently Asked Questions

What is the IUPAC name of N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 141316907) is N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is O=C(Nc1ccccc1)c1ccc(NC(=O)c2cnn3cccnc23)c(N2CCCCC2)c1.
What is the InChIKey of N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is UQUKPMGMQJIHGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N6O2/c32-24(28-19-8-3-1-4-9-19)18-10-11-21(22(16-18)30-13-5-2-6-14-30)29-25(33)20-17-27-31-15-7-12-26-23(20)31/h1,3-4,7-12,15-17H,2,5-6,13-14H2,(H,28,32)(H,29,33).
What are the key properties of N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 440.51 g/mol, XLogP of 4.22, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(phenylcarbamoyl)-2-piperidin-1-ylphenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 141316907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).