N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide

C20H22N4O — CID 141134406

IUPACN-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2ccc3n[nH]c(C4CCNCC4)c3c2)cc1
InChIInChI=1S/C20H22N4O/c1-13(25)22-17-5-2-14(3-6-17)16-4-7-19-18(12-16)20(24-23-19)15-8-10-21-11-9-15/h2-7,12,15,21H,8-11H2,1H3,(H,22,25)(H,23,24)
InChIKeyAVUPZKGFWSNCEU-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.66
Rot. Bonds3

About N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide

N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide (PubChem CID 141134406) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide
PubChem CID141134406
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC NameN-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2ccc3n[nH]c(C4CCNCC4)c3c2)cc1
InChIInChI=1S/C20H22N4O/c1-13(25)22-17-5-2-14(3-6-17)16-4-7-19-18(12-16)20(24-23-19)15-8-10-21-11-9-15/h2-7,12,15,21H,8-11H2,1H3,(H,22,25)(H,23,24)
InChIKeyAVUPZKGFWSNCEU-UHFFFAOYSA-N
XLogP3.66
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(1-Benzyl-piperidin-4-yl)-ethyl]-1H-indazole
CID 9996081
N-(5-phenyl-1H-indazol-3-yl)butanamide
CID 6539551
Mkk7-cov-3
CID 135398122
1-(4-{[2-(1H-indazol-3-yl)-1H-indol-5-yl]methyl}piperazin-1-yl)ethan-1-one
CID 135559055
(2'S,3R)-2'-[3-[(E)-2-[4-[(dimethylamino)methyl]phenyl]ethenyl]-1H-indazol-6-yl]-5-methylspiro[1H-indole-3,1'-cyclopropane]-2-one
CID 58486136
(2'S,3R)-2'-[3-[(E)-2-(4-piperazin-1-ylphenyl)ethenyl]-1H-indazol-6-yl]spiro[1H-indole-3,1'-cyclopropane]-2-one
CID 58486138
2-(1H-indazol-1-yl)-N-(4-isopropylphenyl)acetamide
CID 20885372
N-[[1-(2-anilino-2-oxoethyl)piperidin-4-yl]methyl]-5-methyl-1H-indazole-3-carboxamide
CID 9889536
4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-1H-indazol-5-yl]-benzamide
CID 9950390
1-[2-(4-Benzyl-piperidin-1-ylmethyl)-phenyl]-3-(1H-indazol-6-yl)-urea
CID 11091447
2-phenyl-N-(3-(2-phenylcyclopropyl)-1H-indazol-5-yl)acetamide
CID 16070056
1-benzyl-N-(1H-indazol-5-yl)piperidine-4-carboxamide
CID 22933424

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide?
The IUPAC name of N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide (CID 141134406) is N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide.
What is the SMILES notation for N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide?
The canonical SMILES for N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide is CC(=O)Nc1ccc(-c2ccc3n[nH]c(C4CCNCC4)c3c2)cc1.
What is the InChIKey of N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide?
The InChIKey is AVUPZKGFWSNCEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-13(25)22-17-5-2-14(3-6-17)16-4-7-19-18(12-16)20(24-23-19)15-8-10-21-11-9-15/h2-7,12,15,21H,8-11H2,1H3,(H,22,25)(H,23,24).
What are the key properties of N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide?
N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide has a molecular weight of 334.42 g/mol, XLogP of 3.66, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-piperidin-4-yl-2H-indazol-5-yl)phenyl]acetamide is sourced from PubChem (CID 141134406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).