N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide

C20H20N4O2 — CID 129352847

IUPACN-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1ccc(CN2CC[C@H](NC(=O)c3cnn4ccccc34)C2=O)cc1
InChIInChI=1S/C20H20N4O2/c1-14-5-7-15(8-6-14)13-23-11-9-17(20(23)26)22-19(25)16-12-21-24-10-3-2-4-18(16)24/h2-8,10,12,17H,9,11,13H2,1H3,(H,22,25)/t17-/m0/s1
InChIKeyKMQTWSVMWDOPTF-KRWDZBQOSA-N
MW348.41 g/mol
LogP2.17
Rot. Bonds4

About N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide

N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 129352847) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID129352847
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC NameN-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1ccc(CN2CC[C@H](NC(=O)c3cnn4ccccc34)C2=O)cc1
InChIInChI=1S/C20H20N4O2/c1-14-5-7-15(8-6-14)13-23-11-9-17(20(23)26)22-19(25)16-12-21-24-10-3-2-4-18(16)24/h2-8,10,12,17H,9,11,13H2,1H3,(H,22,25)/t17-/m0/s1
InChIKeyKMQTWSVMWDOPTF-KRWDZBQOSA-N
XLogP2.17
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 154736341
2,4,5-trifluoro-3-hydroxy-N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]benzamide
CID 129402092
N-(2,6-dioxopiperidin-3-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103822655
2-(1,2-benzoxazol-3-yl)-N-[1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]acetamide
CID 126792782
N-(2-methylprop-2-enyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 104955628
N-[(3R)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]-4H-furo[3,2-b]pyrrole-5-carboxamide
CID 124847797
1-[4-(methoxymethyl)phenyl]-3-[1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]urea
CID 119049842
(3S)-3-hydroxy-1-[(4-methylphenyl)methyl]pyrrolidin-2-one
CID 118207331
N-[(4-ethylcyclohexyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 136524835
2-(5-amino-1H-indol-3-yl)-N-[1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]-2-oxoacetamide
CID 163362078
N-(1-benzyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide
CID 51127250
N-[2-(2-chloro-4-methylanilino)-2-oxoethyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 122135420

Frequently Asked Questions

What is the IUPAC name of N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 129352847) is N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide is Cc1ccc(CN2CC[C@H](NC(=O)c3cnn4ccccc34)C2=O)cc1.
What is the InChIKey of N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is KMQTWSVMWDOPTF-KRWDZBQOSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-14-5-7-15(8-6-14)13-23-11-9-17(20(23)26)22-19(25)16-12-21-24-10-3-2-4-18(16)24/h2-8,10,12,17H,9,11,13H2,1H3,(H,22,25)/t17-/m0/s1.
What are the key properties of N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?
N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 348.41 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-1-[(4-methylphenyl)methyl]-2-oxopyrrolidin-3-yl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 129352847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).