5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

C25H31N5O4 — CID 26136322

IUPAC5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
SMILESCOc1ccc(CCn2nc(C(=O)N(C)C)c3c2CCN(C(=O)Cc2c(C)noc2C)C3)cc1
InChIInChI=1S/C25H31N5O4/c1-16-20(17(2)34-27-16)14-23(31)29-12-11-22-21(15-29)24(25(32)28(3)4)26-30(22)13-10-18-6-8-19(33-5)9-7-18/h6-9H,10-15H2,1-5H3
InChIKeyIIDFEDUYAAFTJQ-UHFFFAOYSA-N
MW465.55 g/mol
LogP2.57
Rot. Bonds7

About 5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide (PubChem CID 26136322) has the molecular formula C25H31N5O4 and a molecular weight of 465.55 g/mol. Its IUPAC name is 5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
PubChem CID26136322
Molecular FormulaC25H31N5O4
Molecular Weight465.55 g/mol
Exact Mass465.24
IUPAC Name5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
SMILESCOc1ccc(CCn2nc(C(=O)N(C)C)c3c2CCN(C(=O)Cc2c(C)noc2C)C3)cc1
InChIInChI=1S/C25H31N5O4/c1-16-20(17(2)34-27-16)14-23(31)29-12-11-22-21(15-29)24(25(32)28(3)4)26-30(22)13-10-18-6-8-19(33-5)9-7-18/h6-9H,10-15H2,1-5H3
InChIKeyIIDFEDUYAAFTJQ-UHFFFAOYSA-N
XLogP2.57
TPSA93.70 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.55
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide with MolForge

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Related Compounds

1-[2-(4-methoxyphenyl)ethyl]-5-(3-methoxypropanoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 56706470
1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-5-[(2-methyl-1H-indol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 26147168
5-(cyclopropanecarbonyl)-1-[2-(4-methoxyphenyl)ethyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 56713769
1-[2-(4-methoxyphenyl)ethyl]-5-(5-methyl-1H-pyrazole-3-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 56718617
1-[2-(4-methoxyphenyl)ethyl]-5-(6-methylpyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 56715066
1-[2-(4-methoxyphenyl)ethyl]-5-(5-methyl-1H-imidazole-4-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 56718705
5-[(1R)-2,2-difluorocyclopropanecarbonyl]-1-[2-(4-methoxyphenyl)ethyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 95190026
5-(2,2-difluorocyclopropanecarbonyl)-1-[2-(4-methoxyphenyl)ethyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 56702063
5-[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]-N,N-dimethyl-1-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 26142162
ethyl 1-[2-(4-methoxyphenyl)ethyl]-5-(1,3-thiazole-5-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate
CID 26230545
N-cyclopropyl-5-(2,6-dimethylpyrimidine-4-carbonyl)-1-[2-(4-methoxyphenyl)ethyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 26226073
ethyl 5-(2-methoxyacetyl)-1-(2-phenylethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate
CID 26136993

Frequently Asked Questions

What is the IUPAC name of 5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?
The IUPAC name of 5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide (CID 26136322) is 5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide.
What is the SMILES notation for 5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?
The canonical SMILES for 5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide is COc1ccc(CCn2nc(C(=O)N(C)C)c3c2CCN(C(=O)Cc2c(C)noc2C)C3)cc1.
What is the InChIKey of 5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?
The InChIKey is IIDFEDUYAAFTJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H31N5O4/c1-16-20(17(2)34-27-16)14-23(31)29-12-11-22-21(15-29)24(25(32)28(3)4)26-30(22)13-10-18-6-8-19(33-5)9-7-18/h6-9H,10-15H2,1-5H3.
What are the key properties of 5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?
5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide has a molecular weight of 465.55 g/mol, XLogP of 2.57, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-1-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 26136322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).