N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide

C18H19N3O2 — CID 110768017

IUPACN-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide
SMILESCOc1cc(C)c(CC(=O)Nc2ccc3cn[nH]c3c2)cc1C
InChIInChI=1S/C18H19N3O2/c1-11-7-17(23-3)12(2)6-14(11)8-18(22)20-15-5-4-13-10-19-21-16(13)9-15/h4-7,9-10H,8H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyDYDVWDBVFFLXMT-UHFFFAOYSA-N
MW309.37 g/mol
LogP3.37
Rot. Bonds4

About N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide

N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide (PubChem CID 110768017) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide.

Molecular Properties

Compound NameN-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide
PubChem CID110768017
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide
SMILESCOc1cc(C)c(CC(=O)Nc2ccc3cn[nH]c3c2)cc1C
InChIInChI=1S/C18H19N3O2/c1-11-7-17(23-3)12(2)6-14(11)8-18(22)20-15-5-4-13-10-19-21-16(13)9-15/h4-7,9-10H,8H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyDYDVWDBVFFLXMT-UHFFFAOYSA-N
XLogP3.37
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-indazol-6-yl)-2-(2-methoxyphenyl)acetamide
CID 36559497
2-(5-chloro-2-methoxy-3-methylphenyl)-N-(1H-indazol-6-yl)acetamide
CID 110769468
N-(1H-indazol-6-yl)-2-(7-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
CID 110770216
N-(1H-indazol-6-yl)-2-(3-methoxyphenyl)acetamide
CID 36561093
N-(4-acetamidophenyl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide
CID 110768014
N-(1H-indazol-6-yl)-2,6-dimethoxybenzamide
CID 110731190
N-(1H-indazol-6-yl)-2-(5-methyl-1,2,4-oxadiazol-3-yl)acetamide
CID 110675279
N-(1H-indazol-6-yl)-3-(2-methylphenyl)propanamide
CID 110731205
2-(4-aminophenyl)-N-(1H-indazol-6-yl)acetamide
CID 43710788
N-(1H-indazol-6-yl)-2-(1H-pyrazol-5-yl)acetamide
CID 84575634
2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1H-indazol-6-yl)acetamide
CID 110770980
N-(1H-indazol-6-yl)-2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 110772201

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide?
The IUPAC name of N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide (CID 110768017) is N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide.
What is the SMILES notation for N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide?
The canonical SMILES for N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide is COc1cc(C)c(CC(=O)Nc2ccc3cn[nH]c3c2)cc1C.
What is the InChIKey of N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide?
The InChIKey is DYDVWDBVFFLXMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-11-7-17(23-3)12(2)6-14(11)8-18(22)20-15-5-4-13-10-19-21-16(13)9-15/h4-7,9-10H,8H2,1-3H3,(H,19,21)(H,20,22).
What are the key properties of N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide?
N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide has a molecular weight of 309.37 g/mol, XLogP of 3.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-6-yl)-2-(4-methoxy-2,5-dimethylphenyl)acetamide is sourced from PubChem (CID 110768017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).