4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide

C20H21N5O2 — CID 23048188

IUPAC4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide
SMILESNC(=O)c1ccccc1-n1nc(C2CCN(C(N)=O)CC2)c2ccccc21
InChIInChI=1S/C20H21N5O2/c21-19(26)15-6-2-4-8-17(15)25-16-7-3-1-5-14(16)18(23-25)13-9-11-24(12-10-13)20(22)27/h1-8,13H,9-12H2,(H2,21,26)(H2,22,27)
InChIKeyNVINERKCWXSNIO-UHFFFAOYSA-N
MW363.42 g/mol
LogP2.38
Rot. Bonds3

About 4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide

4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide (PubChem CID 23048188) has the molecular formula C20H21N5O2 and a molecular weight of 363.42 g/mol. Its IUPAC name is 4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide
PubChem CID23048188
Molecular FormulaC20H21N5O2
Molecular Weight363.42 g/mol
Exact Mass363.17
IUPAC Name4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide
SMILESNC(=O)c1ccccc1-n1nc(C2CCN(C(N)=O)CC2)c2ccccc21
InChIInChI=1S/C20H21N5O2/c21-19(26)15-6-2-4-8-17(15)25-16-7-3-1-5-14(16)18(23-25)13-9-11-24(12-10-13)20(22)27/h1-8,13H,9-12H2,(H2,21,26)(H2,22,27)
InChIKeyNVINERKCWXSNIO-UHFFFAOYSA-N
XLogP2.38
TPSA107.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide?
The IUPAC name of 4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide (CID 23048188) is 4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide.
What is the SMILES notation for 4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide?
The canonical SMILES for 4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide is NC(=O)c1ccccc1-n1nc(C2CCN(C(N)=O)CC2)c2ccccc21.
What is the InChIKey of 4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide?
The InChIKey is NVINERKCWXSNIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O2/c21-19(26)15-6-2-4-8-17(15)25-16-7-3-1-5-14(16)18(23-25)13-9-11-24(12-10-13)20(22)27/h1-8,13H,9-12H2,(H2,21,26)(H2,22,27).
What are the key properties of 4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide?
4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide has a molecular weight of 363.42 g/mol, XLogP of 2.38, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2-carbamoylphenyl)indazol-3-yl]piperidine-1-carboxamide is sourced from PubChem (CID 23048188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).