2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid

C17H16N4O4 — CID 118172746

IUPAC2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid
SMILESCOc1cc2nn(CC(=O)O)cc2cc1NC(=O)c1cccc(C)n1
InChIInChI=1S/C17H16N4O4/c1-10-4-3-5-12(18-10)17(24)19-14-6-11-8-21(9-16(22)23)20-13(11)7-15(14)25-2/h3-8H,9H2,1-2H3,(H,19,24)(H,22,23)
InChIKeyLXXQIPCGRWMZTE-UHFFFAOYSA-N
MW340.34 g/mol
LogP2.09
Rot. Bonds5

About 2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid

2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid (PubChem CID 118172746) has the molecular formula C17H16N4O4 and a molecular weight of 340.34 g/mol. Its IUPAC name is 2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid.

Molecular Properties

Compound Name2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid
PubChem CID118172746
Molecular FormulaC17H16N4O4
Molecular Weight340.34 g/mol
Exact Mass340.12
IUPAC Name2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid
SMILESCOc1cc2nn(CC(=O)O)cc2cc1NC(=O)c1cccc(C)n1
InChIInChI=1S/C17H16N4O4/c1-10-4-3-5-12(18-10)17(24)19-14-6-11-8-21(9-16(22)23)20-13(11)7-15(14)25-2/h3-8H,9H2,1-2H3,(H,19,24)(H,22,23)
InChIKeyLXXQIPCGRWMZTE-UHFFFAOYSA-N
XLogP2.09
TPSA106.34 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.34
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-[2-(3,3-difluoroazetidin-1-yl)ethyl]-6-methoxyindazol-5-yl]-6-methylpyridine-2-carboxamide
CID 164969718
N-[2-(2-hydroxyethyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 129283862
N-[2-(4-formylcyclohexyl)-6-methoxyindazol-5-yl]-6-methylpyridine-2-carboxamide
CID 155438016
2-[6-methoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]indazol-2-yl]acetic acid
CID 118172850
N-[2-(2-iodoethyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 164568000
benzyl 2-[5-[[6-(2-hydroxypropan-2-yl)pyridine-2-carbonyl]amino]-6-methoxyindazol-2-yl]acetate
CID 118182618
benzyl 2-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]acetate
CID 150212264
6-methyl-N-[2-[2-[4-(2-methylbutanoyl)piperazin-1-yl]-2-oxoethyl]-6-propan-2-yloxyindazol-5-yl]pyridine-2-carboxamide
CID 134422827
N-[2-(4-cyano-4-methylcyclohexyl)-6-methoxyindazol-5-yl]-6-methylpyridine-2-carboxamide
CID 175253804
6-(cyclopropylamino)-N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]pyridine-2-carboxamide
CID 122637013
N-(2,5-dimethoxyphenyl)-6-methylpyridine-2-carboxamide
CID 31808969
N-[6-methoxy-2-[1-(3-piperidin-4-ylpropyl)piperidin-4-yl]indazol-5-yl]-6-methylpyridine-2-carboxamide
CID 170051500

Frequently Asked Questions

What is the IUPAC name of 2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid?
The IUPAC name of 2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid (CID 118172746) is 2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid.
What is the SMILES notation for 2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid?
The canonical SMILES for 2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid is COc1cc2nn(CC(=O)O)cc2cc1NC(=O)c1cccc(C)n1.
What is the InChIKey of 2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid?
The InChIKey is LXXQIPCGRWMZTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O4/c1-10-4-3-5-12(18-10)17(24)19-14-6-11-8-21(9-16(22)23)20-13(11)7-15(14)25-2/h3-8H,9H2,1-2H3,(H,19,24)(H,22,23).
What are the key properties of 2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid?
2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid has a molecular weight of 340.34 g/mol, XLogP of 2.09, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-methoxy-5-[(6-methylpyridine-2-carbonyl)amino]indazol-2-yl]acetic acid is sourced from PubChem (CID 118172746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).