6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen

C25H35N5O4 — CID 169132454

IUPAC6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen
SMILESCC(=O)N(C)[C@H]1CCCC(C)C1.COc1cc2[nH]ncc2cc1C(=O)Nc1cccn(C)c1=O.[H][H]
InChIInChI=1S/C15H14N4O3.C10H19NO.H2/c1-19-5-3-4-11(15(19)21)17-14(20)10-6-9-8-16-18-12(9)7-13(10)22-2;1-8-5-4-6-10(7-8)11(3)9(2)12;/h3-8H,1-2H3,(H,16,18)(H,17,20);8,10H,4-7H2,1-3H3;1H/t;8?,10-;/m.0./s1
InChIKeyUCEUGBBHWUGABJ-IFDUEINYSA-N
MW469.59 g/mol
LogP3.81
Rot. Bonds4

About 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen

6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen (PubChem CID 169132454) has the molecular formula C25H35N5O4 and a molecular weight of 469.59 g/mol. Its IUPAC name is 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen.

Molecular Properties

Compound Name6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen
PubChem CID169132454
Molecular FormulaC25H35N5O4
Molecular Weight469.59 g/mol
Exact Mass469.27
IUPAC Name6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen
SMILESCC(=O)N(C)[C@H]1CCCC(C)C1.COc1cc2[nH]ncc2cc1C(=O)Nc1cccn(C)c1=O.[H][H]
InChIInChI=1S/C15H14N4O3.C10H19NO.H2/c1-19-5-3-4-11(15(19)21)17-14(20)10-6-9-8-16-18-12(9)7-13(10)22-2;1-8-5-4-6-10(7-8)11(3)9(2)12;/h3-8H,1-2H3,(H,16,18)(H,17,20);8,10H,4-7H2,1-3H3;1H/t;8?,10-;/m.0./s1
InChIKeyUCEUGBBHWUGABJ-IFDUEINYSA-N
XLogP3.81
TPSA109.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500469.59
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-{[cis-4-(2-Phenoxyethyl)cyclohexyl]methyl}-1H-indazole-5-carboxamide
CID 44442113
N-(cyclopropyl(phenyl)methyl)-3-(4-((1-methylpiperidin-4-yl)oxy)phenyl)-1H-indazole-5-carboxamide
CID 89509708
N-[cyclopropyl(phenyl)methyl]-3-[4-[1-[2-(dimethylamino)acetyl]piperidin-4-yl]oxyphenyl]-1H-indazole-5-carboxamide
CID 89509786
6-hydroxy-N-[(4-methoxyphenyl)methyl]-N-methyl-3-[(3-methylphenyl)methyl]-1H-indazole-5-carboxamide
CID 137630304
N-[(3,4-dimethoxyphenyl)methyl]-6-hydroxy-N-methyl-3-[(3-methylphenyl)methyl]-1H-indazole-5-carboxamide
CID 137630316
3-benzyl-N-[(4-ethoxyphenyl)methyl]-6-hydroxy-N-methyl-1H-indazole-5-carboxamide
CID 137630325
3-benzyl-N-[(2,3-dimethoxyphenyl)methyl]-6-hydroxy-N-methyl-1H-indazole-5-carboxamide
CID 137630341
3-benzyl-6-hydroxy-N-[(3-methoxyphenyl)methyl]-N-methyl-1H-indazole-5-carboxamide
CID 137630344
6-hydroxy-N-(3-methoxyphenyl)-N-methyl-3-[(3-methylphenyl)methyl]-1H-indazole-5-carboxamide
CID 145966299
6-hydroxy-N-(4-methoxyphenyl)-N-methyl-3-[(3-methylphenyl)methyl]-1H-indazole-5-carboxamide
CID 145967307
N-[(3R)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-3-(1H-indazol-6-yl)-1H-indazole-5-carboxamide
CID 56591398
1'-(7-methyl-1H-indazole-5-carbonyl)-6-(1H-pyrazol-5-yl)spiro[3H-chromene-2,4'-piperidine]-4-one
CID 46884797

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen?
The IUPAC name of 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen (CID 169132454) is 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen.
What is the SMILES notation for 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen?
The canonical SMILES for 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen is CC(=O)N(C)[C@H]1CCCC(C)C1.COc1cc2[nH]ncc2cc1C(=O)Nc1cccn(C)c1=O.[H][H].
What is the InChIKey of 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen?
The InChIKey is UCEUGBBHWUGABJ-IFDUEINYSA-N. The full InChI is InChI=1S/C15H14N4O3.C10H19NO.H2/c1-19-5-3-4-11(15(19)21)17-14(20)10-6-9-8-16-18-12(9)7-13(10)22-2;1-8-5-4-6-10(7-8)11(3)9(2)12;/h3-8H,1-2H3,(H,16,18)(H,17,20);8,10H,4-7H2,1-3H3;1H/t;8?,10-;/m.0./s1.
What are the key properties of 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen?
6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen has a molecular weight of 469.59 g/mol, XLogP of 3.81, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(1-methyl-2-oxo-3-pyridinyl)-1H-indazole-5-carboxamide;N-methyl-N-[(1S)-3-methylcyclohexyl]acetamide;molecular hydrogen is sourced from PubChem (CID 169132454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).