N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide

C23H30N4O2 — CID 24506300

IUPACN-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1cccc(OCCN(C)C(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)c1
InChIInChI=1S/C23H30N4O2/c1-15(2)21-13-19(20-14-24-27(16(3)4)22(20)25-21)23(28)26(6)10-11-29-18-9-7-8-17(5)12-18/h7-9,12-16H,10-11H2,1-6H3
InChIKeyKMECLXXJCYXHOW-UHFFFAOYSA-N
MW394.52 g/mol
LogP4.60
Rot. Bonds7

About N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide

N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 24506300) has the molecular formula C23H30N4O2 and a molecular weight of 394.52 g/mol. Its IUPAC name is N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID24506300
Molecular FormulaC23H30N4O2
Molecular Weight394.52 g/mol
Exact Mass394.24
IUPAC NameN-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1cccc(OCCN(C)C(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)c1
InChIInChI=1S/C23H30N4O2/c1-15(2)21-13-19(20-14-24-27(16(3)4)22(20)25-21)23(28)26(6)10-11-29-18-9-7-8-17(5)12-18/h7-9,12-16H,10-11H2,1-6H3
InChIKeyKMECLXXJCYXHOW-UHFFFAOYSA-N
XLogP4.60
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-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-benzyl-N-(2-methoxyethyl)-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 46546304
6-cyclopropyl-N-[2-(3-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 9394148
3-chloro-N-methyl-N-[2-(3-methylphenoxy)ethyl]pyridine-4-carboxamide
CID 66483737
N-butyl-N-ethyl-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 134015253
N-[2-(4-chlorophenoxy)ethyl]-N,6-dimethyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 46684152
2-fluoro-N-methyl-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide
CID 107358744
N,1,6-tri(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 27648180
N,6-dimethyl-1-propan-2-yl-N-(3,3,3-trifluoropropyl)pyrazolo[3,4-b]pyridine-4-carboxamide
CID 86833507
benzyl 1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxylate
CID 8907534
4-[methyl-(6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]butanoic acid
CID 119346929
N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenoxypyridine-3-carboxamide
CID 55431158
N-[2-(3-methoxyanilino)-2-oxoethyl]-N-methyl-6-(5-methylthiophen-2-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 46577418

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide (CID 24506300) is N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide is Cc1cccc(OCCN(C)C(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)c1.
What is the InChIKey of N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is KMECLXXJCYXHOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O2/c1-15(2)21-13-19(20-14-24-27(16(3)4)22(20)25-21)23(28)26(6)10-11-29-18-9-7-8-17(5)12-18/h7-9,12-16H,10-11H2,1-6H3.
What are the key properties of N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 394.52 g/mol, XLogP of 4.60, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(3-methylphenoxy)ethyl]-1,6-di(propan-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 24506300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).