6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride

C20H25ClN4O3 — CID 120601204

IUPAC6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride
SMILESCc1cc(-c2cc(C(=O)NC3CCNC(C)C3)c3c(C)noc3n2)c(C)o1.Cl
InChIInChI=1S/C20H24N4O3.ClH/c1-10-7-14(5-6-21-10)22-19(25)16-9-17(15-8-11(2)26-13(15)4)23-20-18(16)12(3)24-27-20;/h8-10,14,21H,5-7H2,1-4H3,(H,22,25);1H
InChIKeyNCPCGCCMFBLPRX-UHFFFAOYSA-N
MW404.90 g/mol
LogP3.70
Rot. Bonds3

About 6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride

6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride (PubChem CID 120601204) has the molecular formula C20H25ClN4O3 and a molecular weight of 404.90 g/mol. Its IUPAC name is 6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride
PubChem CID120601204
Molecular FormulaC20H25ClN4O3
Molecular Weight404.90 g/mol
Exact Mass404.16
IUPAC Name6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride
SMILESCc1cc(-c2cc(C(=O)NC3CCNC(C)C3)c3c(C)noc3n2)c(C)o1.Cl
InChIInChI=1S/C20H24N4O3.ClH/c1-10-7-14(5-6-21-10)22-19(25)16-9-17(15-8-11(2)26-13(15)4)23-20-18(16)12(3)24-27-20;/h8-10,14,21H,5-7H2,1-4H3,(H,22,25);1H
InChIKeyNCPCGCCMFBLPRX-UHFFFAOYSA-N
XLogP3.70
TPSA93.19 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.90
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride 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

6-(2,5-dimethylfuran-3-yl)-3-methyl-N-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride
CID 119388168
6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-3-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 120576654
6-(2,5-dimethylfuran-3-yl)-3-methyl-N-[1-(3-methylbut-2-enyl)piperidin-4-yl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 56568829
2,5-dimethyl-N-(2-methylpiperidin-4-yl)furan-3-carboxamide;hydrochloride
CID 120600731
N-[2-(aminomethyl)cyclohexyl]-6-(2,5-dimethylfuran-3-yl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 119610903
N-(2-aminoethyl)-6-(2,5-dimethylfuran-3-yl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 119383829
6-(2,5-dimethylfuran-3-yl)-N-methoxy-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 33103458
3-[[6-(2,5-dimethylfuran-3-yl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carbonyl]amino]propanoic acid
CID 119351483
6-(2,5-dimethylfuran-3-yl)-N,3-dimethyl-N-piperidin-4-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 119442897
2-[[6-(2,5-dimethylfuran-3-yl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carbonyl]amino]propanoic acid
CID 119349124
6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(oxan-2-yloxy)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 51130599
[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-[6-(2,5-dimethylfuran-3-yl)-3-methyl-[1,2]oxazolo[5,4-b]pyridin-4-yl]methanone;hydrochloride
CID 120660139

Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride?
The IUPAC name of 6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride (CID 120601204) is 6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride.
What is the SMILES notation for 6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride?
The canonical SMILES for 6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride is Cc1cc(-c2cc(C(=O)NC3CCNC(C)C3)c3c(C)noc3n2)c(C)o1.Cl.
What is the InChIKey of 6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride?
The InChIKey is NCPCGCCMFBLPRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O3.ClH/c1-10-7-14(5-6-21-10)22-19(25)16-9-17(15-8-11(2)26-13(15)4)23-20-18(16)12(3)24-27-20;/h8-10,14,21H,5-7H2,1-4H3,(H,22,25);1H.
What are the key properties of 6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride?
6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride has a molecular weight of 404.90 g/mol, XLogP of 3.70, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dimethylfuran-3-yl)-3-methyl-N-(2-methylpiperidin-4-yl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide;hydrochloride is sourced from PubChem (CID 120601204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).