5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide

C18H17ClN4O3 — CID 162657961

IUPAC5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide
SMILESCN(C)C(=O)Cn1cc2c(NC(=O)c3cc(Cl)ccc3O)cccc2n1
InChIInChI=1S/C18H17ClN4O3/c1-22(2)17(25)10-23-9-13-14(4-3-5-15(13)21-23)20-18(26)12-8-11(19)6-7-16(12)24/h3-9,24H,10H2,1-2H3,(H,20,26)
InChIKeyQEVYYJKDSJANQL-UHFFFAOYSA-N
MW372.81 g/mol
LogP2.74
Rot. Bonds4

About 5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide

5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide (PubChem CID 162657961) has the molecular formula C18H17ClN4O3 and a molecular weight of 372.81 g/mol. Its IUPAC name is 5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide
PubChem CID162657961
Molecular FormulaC18H17ClN4O3
Molecular Weight372.81 g/mol
Exact Mass372.10
IUPAC Name5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide
SMILESCN(C)C(=O)Cn1cc2c(NC(=O)c3cc(Cl)ccc3O)cccc2n1
InChIInChI=1S/C18H17ClN4O3/c1-22(2)17(25)10-23-9-13-14(4-3-5-15(13)21-23)20-18(26)12-8-11(19)6-7-16(12)24/h3-9,24H,10H2,1-2H3,(H,20,26)
InChIKeyQEVYYJKDSJANQL-UHFFFAOYSA-N
XLogP2.74
TPSA87.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.81
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-N-[2-chloro-4-(1H-indazol-6-ylmethylamino)phenyl]-2-hydroxybenzamide
CID 162650964
N-(1-benzoylindazol-5-yl)-5-chloro-2-hydroxybenzamide
CID 162654219
5-chloro-2-hydroxy-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 45838541
5-chloro-2-hydroxy-N-(1H-indol-4-yl)benzamide
CID 54413444
4-[(5-chloro-2-hydroxybenzoyl)amino]-N,N-dimethylindazole-2-carboxamide
CID 162645164
3-[4-[(5-Chloro-2-hydroxybenzoyl)amino]indazol-2-yl]propanoic acid
CID 162645379
4-[(5-chloro-2-hydroxybenzoyl)amino]-N-(4-methoxyphenyl)indazole-1-carboxamide
CID 162646382
5-chloro-2-hydroxy-N-(1H-indazol-6-yl)benzamide
CID 162648074
N-(1-benzoylindol-5-yl)-5-chloro-2-hydroxybenzamide
CID 162648350
5-chloro-2-hydroxy-N-(1H-indazol-4-yl)benzamide
CID 162651675
5-chloro-2-hydroxy-N-(1H-indazol-5-yl)benzamide
CID 162652371
Methyl 3-[4-[(5-chloro-2-hydroxybenzoyl)amino]indazol-2-yl]propanoate
CID 162652629

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide?
The IUPAC name of 5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide (CID 162657961) is 5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide.
What is the SMILES notation for 5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide?
The canonical SMILES for 5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide is CN(C)C(=O)Cn1cc2c(NC(=O)c3cc(Cl)ccc3O)cccc2n1.
What is the InChIKey of 5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide?
The InChIKey is QEVYYJKDSJANQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN4O3/c1-22(2)17(25)10-23-9-13-14(4-3-5-15(13)21-23)20-18(26)12-8-11(19)6-7-16(12)24/h3-9,24H,10H2,1-2H3,(H,20,26).
What are the key properties of 5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide?
5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide has a molecular weight of 372.81 g/mol, XLogP of 2.74, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-[2-(dimethylamino)-2-oxoethyl]indazol-4-yl]-2-hydroxybenzamide is sourced from PubChem (CID 162657961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).