2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide

C21H24N4O2 — CID 22036603

IUPAC2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide
SMILESO=C(Cc1ccc(O)cc1)Nc1ccc2cnn(CCN3CCCC3)c2c1
InChIInChI=1S/C21H24N4O2/c26-19-7-3-16(4-8-19)13-21(27)23-18-6-5-17-15-22-25(20(17)14-18)12-11-24-9-1-2-10-24/h3-8,14-15,26H,1-2,9-13H2,(H,23,27)
InChIKeyKDBSGGWWWMVKFW-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.02
Rot. Bonds6

About 2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide

2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide (PubChem CID 22036603) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide
PubChem CID22036603
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC Name2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide
SMILESO=C(Cc1ccc(O)cc1)Nc1ccc2cnn(CCN3CCCC3)c2c1
InChIInChI=1S/C21H24N4O2/c26-19-7-3-16(4-8-19)13-21(27)23-18-6-5-17-15-22-25(20(17)14-18)12-11-24-9-1-2-10-24/h3-8,14-15,26H,1-2,9-13H2,(H,23,27)
InChIKeyKDBSGGWWWMVKFW-UHFFFAOYSA-N
XLogP3.02
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-phenylmethoxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide
CID 11775399
2-[4-[(4-fluorophenyl)methoxy]phenyl]-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide
CID 11213617
1-[(4-phenoxyphenyl)methyl]-3-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]urea
CID 11396908
2-(3-phenoxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]acetamide
CID 11517811
N-[3-bromo-1-(2-pyrrolidin-1-ylethyl)indazol-5-yl]-2-(4-phenoxyphenyl)acetamide
CID 11504558
N-(1-ethylindazol-6-yl)-2-(methylamino)acetamide;hydrochloride
CID 119752857
N-(1-ethylindazol-6-yl)-2-(3-methoxyphenyl)acetamide
CID 47083910
2-indazol-1-yl-N-[3-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CID 131952566
2-(3,4-dichlorophenyl)-N-[4-(2-pyrrolidin-1-ylethyl)phenyl]acetamide
CID 60575166
N-(1-naphthalen-1-ylsulfonylindazol-6-yl)-3-piperidin-1-ylpropanamide
CID 24771124
2-(2-chlorophenyl)-N-[1-(oxolan-2-ylmethyl)indazol-6-yl]acetamide
CID 164945436
2-(4-hydroxyphenyl)-N-(1H-indazol-5-yl)acetamide
CID 23570801

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide?
The IUPAC name of 2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide (CID 22036603) is 2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide.
What is the SMILES notation for 2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide?
The canonical SMILES for 2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide is O=C(Cc1ccc(O)cc1)Nc1ccc2cnn(CCN3CCCC3)c2c1.
What is the InChIKey of 2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide?
The InChIKey is KDBSGGWWWMVKFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c26-19-7-3-16(4-8-19)13-21(27)23-18-6-5-17-15-22-25(20(17)14-18)12-11-24-9-1-2-10-24/h3-8,14-15,26H,1-2,9-13H2,(H,23,27).
What are the key properties of 2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide?
2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide has a molecular weight of 364.45 g/mol, XLogP of 3.02, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide is sourced from PubChem (CID 22036603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).