4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide

C19H18Cl2N4O2 — CID 11774091

IUPAC4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide
SMILESO=C(Nc1n[nH]c2ccccc12)N1CCC(O)(c2ccc(Cl)c(Cl)c2)CC1
InChIInChI=1S/C19H18Cl2N4O2/c20-14-6-5-12(11-15(14)21)19(27)7-9-25(10-8-19)18(26)22-17-13-3-1-2-4-16(13)23-24-17/h1-6,11,27H,7-10H2,(H2,22,23,24,26)
InChIKeyDYYUZASEUPBQSO-UHFFFAOYSA-N
MW405.29 g/mol
LogP4.39
Rot. Bonds2

About 4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide

4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide (PubChem CID 11774091) has the molecular formula C19H18Cl2N4O2 and a molecular weight of 405.29 g/mol. Its IUPAC name is 4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide
PubChem CID11774091
Molecular FormulaC19H18Cl2N4O2
Molecular Weight405.29 g/mol
Exact Mass404.08
IUPAC Name4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide
SMILESO=C(Nc1n[nH]c2ccccc12)N1CCC(O)(c2ccc(Cl)c(Cl)c2)CC1
InChIInChI=1S/C19H18Cl2N4O2/c20-14-6-5-12(11-15(14)21)19(27)7-9-25(10-8-19)18(26)22-17-13-3-1-2-4-16(13)23-24-17/h1-6,11,27H,7-10H2,(H2,22,23,24,26)
InChIKeyDYYUZASEUPBQSO-UHFFFAOYSA-N
XLogP4.39
TPSA81.25 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.29
LogP ≤ 54.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,5-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide
CID 11338671
4-hydroxy-N-(1H-indazol-3-yl)-4-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 11441481
4-hydroxy-N-(1H-indazol-3-yl)-4-[3-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 11177159
4-[3-fluoro-5-(trifluoromethyl)phenyl]-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide
CID 11281628
4-(3-chloro-2-methylphenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide
CID 58926861
3-(4-fluorophenyl)-3-hydroxy-N-(1H-indazol-3-yl)pyrrolidine-1-carboxamide
CID 58926880
3-[[4-[4-chloro-3-(trifluoromethyl)phenyl]-4-hydroxypiperidine-1-carbonyl]amino]indazole-1-carboxylic acid
CID 23149915
[4-hydroxy-4-(3-methylphenyl)piperidin-1-yl] N-(1H-indazol-3-yl)carbamate
CID 118555436
4-[4-fluoro-3-(trifluoromethyl)phenyl]-N-(1H-indazol-3-yl)piperazine-1-carboxamide
CID 11304338
4-(3-chloro-4-fluorophenyl)-N-(1H-indazol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide
CID 11337695
5-chloro-N-(1H-indazol-3-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxamide
CID 11485368
2,5-dichloro-N-(1H-indazol-3-yl)benzamide
CID 60729962

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide?
The IUPAC name of 4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide (CID 11774091) is 4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide?
The canonical SMILES for 4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide is O=C(Nc1n[nH]c2ccccc12)N1CCC(O)(c2ccc(Cl)c(Cl)c2)CC1.
What is the InChIKey of 4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide?
The InChIKey is DYYUZASEUPBQSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18Cl2N4O2/c20-14-6-5-12(11-15(14)21)19(27)7-9-25(10-8-19)18(26)22-17-13-3-1-2-4-16(13)23-24-17/h1-6,11,27H,7-10H2,(H2,22,23,24,26).
What are the key properties of 4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide?
4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide has a molecular weight of 405.29 g/mol, XLogP of 4.39, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dichlorophenyl)-4-hydroxy-N-(1H-indazol-3-yl)piperidine-1-carboxamide is sourced from PubChem (CID 11774091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).