N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide

C19H24N2O4S — CID 58256209

IUPACN-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide
SMILESCC(C)CCN(C1(C(=O)NO)CC1)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C19H24N2O4S/c1-14(2)9-12-21(19(10-11-19)18(22)20-23)26(24,25)17-8-7-15-5-3-4-6-16(15)13-17/h3-8,13-14,23H,9-12H2,1-2H3,(H,20,22)
InChIKeyYNTKPIGVFKHEHT-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.91
Rot. Bonds7

About N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide

N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide (PubChem CID 58256209) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide
PubChem CID58256209
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide
SMILESCC(C)CCN(C1(C(=O)NO)CC1)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C19H24N2O4S/c1-14(2)9-12-21(19(10-11-19)18(22)20-23)26(24,25)17-8-7-15-5-3-4-6-16(15)13-17/h3-8,13-14,23H,9-12H2,1-2H3,(H,20,22)
InChIKeyYNTKPIGVFKHEHT-UHFFFAOYSA-N
XLogP2.91
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

(2R)-N-hydroxy-2-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]-4-phenylbutanamide
CID 44608939
(2R)-N-hydroxy-3-methyl-2-[3-methylbutyl-(6-methylnaphthalen-2-yl)sulfonylamino]butanamide
CID 87289862
N-hydroxy-3-methyl-2-[3-methylbutyl-(7-methylnaphthalen-2-yl)sulfonylamino]butanamide
CID 76747684
(2R)-N-hydroxy-2-[(7-hydroxynaphthalen-2-yl)sulfonyl-(3-methylbutyl)amino]-3-methylbutanamide
CID 57394732
(2R)-N-hydroxy-3-methyl-2-[naphthalen-2-ylsulfonyl(prop-2-enyl)amino]butanamide
CID 58256163
(2R)-2-[(7-aminonaphthalen-2-yl)sulfonyl-(3-methylbutyl)amino]-N-hydroxypropanamide
CID 143926014
2-[hexyl(naphthalen-2-ylsulfonyl)amino]-N-hydroxyacetamide
CID 143926016
(2R,3R)-N-hydroxy-5-methyl-2-[[methyl(naphthalen-2-ylsulfonyl)amino]methyl]-3-(piperidine-1-carbonyl)hexanamide
CID 54534379
4-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-hydroxy-1-methylpiperidine-4-carboxamide
CID 22907066
2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-[(2S)-pentan-2-yl]acetamide
CID 92518793
3-[2-[2-carboxyethyl(naphthalen-2-ylsulfonyl)amino]ethyl-naphthalen-2-ylsulfonylamino]propanoic acid
CID 151966350
(2R)-2-[2-(4-chlorophenoxy)ethyl-naphthalen-2-ylsulfonylamino]-N-hydroxy-3-methylbutanamide
CID 58256217

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide?
The IUPAC name of N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide (CID 58256209) is N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide.
What is the SMILES notation for N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide?
The canonical SMILES for N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide is CC(C)CCN(C1(C(=O)NO)CC1)S(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide?
The InChIKey is YNTKPIGVFKHEHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-14(2)9-12-21(19(10-11-19)18(22)20-23)26(24,25)17-8-7-15-5-3-4-6-16(15)13-17/h3-8,13-14,23H,9-12H2,1-2H3,(H,20,22).
What are the key properties of N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide?
N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide has a molecular weight of 376.48 g/mol, XLogP of 2.91, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-1-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]cyclopropane-1-carboxamide is sourced from PubChem (CID 58256209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).