N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide

C20H19N5O2 — CID 126601382

IUPACN-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide
SMILESCn1nccc1-c1ccc2c(cnn2C(Cc2ccccc2)C(=O)NO)c1
InChIInChI=1S/C20H19N5O2/c1-24-17(9-10-21-24)15-7-8-18-16(12-15)13-22-25(18)19(20(26)23-27)11-14-5-3-2-4-6-14/h2-10,12-13,19,27H,11H2,1H3,(H,23,26)
InChIKeyBPZVFYQIDFDXDM-UHFFFAOYSA-N
MW361.41 g/mol
LogP2.73
Rot. Bonds5

About N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide

N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide (PubChem CID 126601382) has the molecular formula C20H19N5O2 and a molecular weight of 361.41 g/mol. Its IUPAC name is N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide
PubChem CID126601382
Molecular FormulaC20H19N5O2
Molecular Weight361.41 g/mol
Exact Mass361.15
IUPAC NameN-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide
SMILESCn1nccc1-c1ccc2c(cnn2C(Cc2ccccc2)C(=O)NO)c1
InChIInChI=1S/C20H19N5O2/c1-24-17(9-10-21-24)15-7-8-18-16(12-15)13-22-25(18)19(20(26)23-27)11-14-5-3-2-4-6-14/h2-10,12-13,19,27H,11H2,1H3,(H,23,26)
InChIKeyBPZVFYQIDFDXDM-UHFFFAOYSA-N
XLogP2.73
TPSA84.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.41
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide?
The IUPAC name of N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide (CID 126601382) is N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide.
What is the SMILES notation for N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide?
The canonical SMILES for N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide is Cn1nccc1-c1ccc2c(cnn2C(Cc2ccccc2)C(=O)NO)c1.
What is the InChIKey of N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide?
The InChIKey is BPZVFYQIDFDXDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O2/c1-24-17(9-10-21-24)15-7-8-18-16(12-15)13-22-25(18)19(20(26)23-27)11-14-5-3-2-4-6-14/h2-10,12-13,19,27H,11H2,1H3,(H,23,26).
What are the key properties of N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide?
N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide has a molecular weight of 361.41 g/mol, XLogP of 2.73, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[5-(2-methylpyrazol-3-yl)indazol-1-yl]-3-phenylpropanamide is sourced from PubChem (CID 126601382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).