N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide

C22H24N4O2 — CID 126601525

IUPACN-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide
SMILESCN1CC=C(c2cccc3c2cnn3C(Cc2ccccc2)C(=O)NO)CC1
InChIInChI=1S/C22H24N4O2/c1-25-12-10-17(11-13-25)18-8-5-9-20-19(18)15-23-26(20)21(22(27)24-28)14-16-6-3-2-4-7-16/h2-10,15,21,28H,11-14H2,1H3,(H,24,27)
InChIKeyHQKRDBQABOGGON-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.04
Rot. Bonds5

About N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide

N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide (PubChem CID 126601525) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide
PubChem CID126601525
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC NameN-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide
SMILESCN1CC=C(c2cccc3c2cnn3C(Cc2ccccc2)C(=O)NO)CC1
InChIInChI=1S/C22H24N4O2/c1-25-12-10-17(11-13-25)18-8-5-9-20-19(18)15-23-26(20)21(22(27)24-28)14-16-6-3-2-4-7-16/h2-10,15,21,28H,11-14H2,1H3,(H,24,27)
InChIKeyHQKRDBQABOGGON-UHFFFAOYSA-N
XLogP3.04
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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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Related Compounds

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5-[1-[(3-anilinophenyl)methyl]pyrazol-3-yl]-N-hydroxypentanamide
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N-[4-[4-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methylcarbamoyl]-1-propan-2-ylindazol-6-yl]phenyl]-N'-hydroxyoctanediamide
CID 168280130
N-[4-[4-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methylcarbamoyl]-1-propan-2-ylindazol-6-yl]phenyl]-N'-hydroxyheptanediamide
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2-[(4-Aminoindazol-1-yl)methyl]-5-methyl-3-(2-methylphenyl)quinazolin-4-one
CID 53348180
(R)-1-(4-(1H-indazol-5-yl)piperazin-1-yl)-2-amino-2-phenylethanone
CID 16662098
(R)-1-(4-(1H-indazol-5-yl)piperazin-1-yl)-2-amino-3-phenylpropan-1-one
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(S)-1-(4-(1H-indazol-5-ylamino)piperidin-1-yl)-2-amino-2-phenylethanone
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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide?
The IUPAC name of N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide (CID 126601525) is N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide.
What is the SMILES notation for N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide?
The canonical SMILES for N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide is CN1CC=C(c2cccc3c2cnn3C(Cc2ccccc2)C(=O)NO)CC1.
What is the InChIKey of N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide?
The InChIKey is HQKRDBQABOGGON-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-25-12-10-17(11-13-25)18-8-5-9-20-19(18)15-23-26(20)21(22(27)24-28)14-16-6-3-2-4-7-16/h2-10,15,21,28H,11-14H2,1H3,(H,24,27).
What are the key properties of N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide?
N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide has a molecular weight of 376.46 g/mol, XLogP of 3.04, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indazol-1-yl]-3-phenylpropanamide is sourced from PubChem (CID 126601525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).