N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide

C24H23N3O3 — CID 146269042

IUPACN-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2c(=O)[nH]n3ccccc23)c(C(C)C)cc1Oc1ccccc1
InChIInChI=1S/C24H23N3O3/c1-15(2)18-14-21(30-17-9-5-4-6-10-17)16(3)13-19(18)25-23(28)22-20-11-7-8-12-27(20)26-24(22)29/h4-15H,1-3H3,(H,25,28)(H,26,29)
InChIKeyJABKJLQKEVJGOT-UHFFFAOYSA-N
MW401.47 g/mol
LogP5.10
Rot. Bonds5

About N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide

N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 146269042) has the molecular formula C24H23N3O3 and a molecular weight of 401.47 g/mol. Its IUPAC name is N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID146269042
Molecular FormulaC24H23N3O3
Molecular Weight401.47 g/mol
Exact Mass401.17
IUPAC NameN-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2c(=O)[nH]n3ccccc23)c(C(C)C)cc1Oc1ccccc1
InChIInChI=1S/C24H23N3O3/c1-15(2)18-14-21(30-17-9-5-4-6-10-17)16(3)13-19(18)25-23(28)22-20-11-7-8-12-27(20)26-24(22)29/h4-15H,1-3H3,(H,25,28)(H,26,29)
InChIKeyJABKJLQKEVJGOT-UHFFFAOYSA-N
XLogP5.10
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500401.47
LogP ≤ 55.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methyl-4-phenoxyphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide
CID 145954585
N-(2,5-dimethyl-4-phenoxyphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide
CID 145954937
2-oxo-N-(4-phenoxyphenyl)-1H-pyrazolo[1,5-a]pyridine-3-carboxamide
CID 145973351
N-(2-methyl-4-phenoxy-5-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide
CID 163298989
N-[5-methyl-2-propan-2-yl-4-[4-(trifluoromethyl)phenoxy]phenyl]-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide
CID 163299001
2-oxo-N-[2,3,5,6-tetrafluoro-4-(3-propoxyphenyl)phenyl]-1H-pyrazolo[1,5-a]pyridine-3-carboxamide
CID 163299027
N-(2-methyl-4-phenoxyphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide
CID 163299028
3-[(2,5-dimethylanilino)methyl]-6-methoxy-1H-quinolin-2-one
CID 947754
N-[4-[3-(2,2-difluoropropoxy)phenyl]-2,3,5,6-tetrafluorophenyl]-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide
CID 163299017
N-[2-(4-fluorophenyl)ethyl]-1,7-dimethyl-2-oxo-6-pentoxyquinoline-3-carboxamide
CID 23530737
N-[2-(4-fluorophenyl)ethyl]-7-methyl-2-oxo-6-pentoxy-1H-quinoline-3-carboxamide
CID 23530740
[hydroxy-(2-oxo-1H-pyrazolo[1,5-a]pyridin-3-yl)methylidene]-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)azanium
CID 165416382

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide (CID 146269042) is N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide is Cc1cc(NC(=O)c2c(=O)[nH]n3ccccc23)c(C(C)C)cc1Oc1ccccc1.
What is the InChIKey of N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is JABKJLQKEVJGOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O3/c1-15(2)18-14-21(30-17-9-5-4-6-10-17)16(3)13-19(18)25-23(28)22-20-11-7-8-12-27(20)26-24(22)29/h4-15H,1-3H3,(H,25,28)(H,26,29).
What are the key properties of N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide?
N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 401.47 g/mol, XLogP of 5.10, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-4-phenoxy-2-propan-2-ylphenyl)-2-oxo-1H-pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 146269042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).