2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide

C21H24N4O2 — CID 126601465

IUPAC2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide
SMILESCN(Cc1cccc2cn(C(Cc3ccccc3)C(=O)NO)nc12)C1CC1
InChIInChI=1S/C21H24N4O2/c1-24(18-10-11-18)13-16-8-5-9-17-14-25(22-20(16)17)19(21(26)23-27)12-15-6-3-2-4-7-15/h2-9,14,18-19,27H,10-13H2,1H3,(H,23,26)
InChIKeyIJCJBTLTZRIOLS-UHFFFAOYSA-N
MW364.45 g/mol
LogP2.92
Rot. Bonds7

About 2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide

2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide (PubChem CID 126601465) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is 2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide.

Molecular Properties

Compound Name2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide
PubChem CID126601465
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC Name2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide
SMILESCN(Cc1cccc2cn(C(Cc3ccccc3)C(=O)NO)nc12)C1CC1
InChIInChI=1S/C21H24N4O2/c1-24(18-10-11-18)13-16-8-5-9-17-14-25(22-20(16)17)19(21(26)23-27)12-15-6-3-2-4-7-15/h2-9,14,18-19,27H,10-13H2,1H3,(H,23,26)
InChIKeyIJCJBTLTZRIOLS-UHFFFAOYSA-N
XLogP2.92
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.92
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

2-[7-(2-cyclopropylethynyl)indazol-2-yl]-N-hydroxy-3-phenylpropanamide
CID 126601366
2-(5-fluoroindazol-2-yl)-N-hydroxy-3-phenylpropanamide
CID 155883738
2-[2-[[(4-aminocyclohexyl)-methylamino]methyl]phenyl]acetic acid
CID 115463093
(2R)-2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-3-phenylpropanamide
CID 78919866
2-[[[4-[(2-hydroxyphenyl)methyl-methylamino]cyclohexyl]-methylamino]methyl]phenol
CID 118815979
2-[3-(2-cyclopropylethynyl)-7-pyridin-4-ylindazol-2-yl]-N-hydroxy-3-phenylpropanamide
CID 126601505
(2S)-2-[cyclopropyl(methyl)amino]-3-phenylpropanoic acid
CID 175818563
2-[4-(4-methylpiperidin-1-yl)indazol-2-yl]-3-phenylpropanoic acid
CID 140901187
N-hydroxy-3-phenyl-2-(5-pyrimidin-5-ylpyrazolo[4,5-b]pyridin-1-yl)propanamide
CID 126601596
2-(5-chloro-3a,7a-dihydropyrrolo[3,2-b]pyridin-1-yl)-N-hydroxy-3-phenylpropanamide
CID 155883748
cis-(1R,2S)-2-[[1-(hydroxyamino)-1-oxo-3-phenylpropan-2-yl]-methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 22842791
N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-2-[3-[[cyclopropyl(methyl)amino]methyl]pyrazol-1-yl]pyridine-3-carboxamide
CID 71768704

Frequently Asked Questions

What is the IUPAC name of 2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide?
The IUPAC name of 2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide (CID 126601465) is 2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide.
What is the SMILES notation for 2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide?
The canonical SMILES for 2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide is CN(Cc1cccc2cn(C(Cc3ccccc3)C(=O)NO)nc12)C1CC1.
What is the InChIKey of 2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide?
The InChIKey is IJCJBTLTZRIOLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-24(18-10-11-18)13-16-8-5-9-17-14-25(22-20(16)17)19(21(26)23-27)12-15-6-3-2-4-7-15/h2-9,14,18-19,27H,10-13H2,1H3,(H,23,26).
What are the key properties of 2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide?
2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide has a molecular weight of 364.45 g/mol, XLogP of 2.92, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-[[cyclopropyl(methyl)amino]methyl]indazol-2-yl]-N-hydroxy-3-phenylpropanamide is sourced from PubChem (CID 126601465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).