6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide

C26H33N5O4 — CID 154859385

IUPAC6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCOc1ccc(C(CNC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)N2CCOCC2)cc1OC
InChIInChI=1S/C26H33N5O4/c1-16-24-19(14-20(17-5-6-17)28-25(24)30(2)29-16)26(32)27-15-21(31-9-11-35-12-10-31)18-7-8-22(33-3)23(13-18)34-4/h7-8,13-14,17,21H,5-6,9-12,15H2,1-4H3,(H,27,32)
InChIKeyKBVMVEPLLISKLZ-UHFFFAOYSA-N
MW479.58 g/mol
LogP2.97
Rot. Bonds8

About 6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 154859385) has the molecular formula C26H33N5O4 and a molecular weight of 479.58 g/mol. Its IUPAC name is 6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID154859385
Molecular FormulaC26H33N5O4
Molecular Weight479.58 g/mol
Exact Mass479.25
IUPAC Name6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCOc1ccc(C(CNC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)N2CCOCC2)cc1OC
InChIInChI=1S/C26H33N5O4/c1-16-24-19(14-20(17-5-6-17)28-25(24)30(2)29-16)26(32)27-15-21(31-9-11-35-12-10-31)18-7-8-22(33-3)23(13-18)34-4/h7-8,13-14,17,21H,5-6,9-12,15H2,1-4H3,(H,27,32)
InChIKeyKBVMVEPLLISKLZ-UHFFFAOYSA-N
XLogP2.97
TPSA90.74 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500479.58
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide with MolForge

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Related Compounds

N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-1,3-dimethyl-6-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 43043352
6-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 31700057
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,3,6-trimethylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 42955667
N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-2,3-dimethylquinoxaline-6-carboxamide
CID 55388124
N-[(2S)-2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-4-methylbenzamide
CID 25484973
6-cyclopropyl-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 87008688
N-[(2S)-2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 29360681
2-chloro-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-5-[(4,6-dimethylpyrimidin-2-yl)amino]benzamide
CID 155967975
4-[[(6-cyclopropyl-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carbonyl)amino]methyl]oxane-4-carboxylic acid
CID 120542948
6-cyclopropyl-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55515573
N-[(2S)-2-anilino-3-methylbutyl]-6-cyclopropyl-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 95303336
methyl 6-cyclopropyl-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxylate
CID 19616466

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 154859385) is 6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide is COc1ccc(C(CNC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)N2CCOCC2)cc1OC.
What is the InChIKey of 6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is KBVMVEPLLISKLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N5O4/c1-16-24-19(14-20(17-5-6-17)28-25(24)30(2)29-16)26(32)27-15-21(31-9-11-35-12-10-31)18-7-8-22(33-3)23(13-18)34-4/h7-8,13-14,17,21H,5-6,9-12,15H2,1-4H3,(H,27,32).
What are the key properties of 6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 479.58 g/mol, XLogP of 2.97, 8 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 154859385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).