N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide

C15H18N2O4S — CID 87026861

IUPACN'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide
SMILESO=C(NNS(=O)(=O)C1=Cc2ccccc2CC1)C1CCCO1
InChIInChI=1S/C15H18N2O4S/c18-15(14-6-3-9-21-14)16-17-22(19,20)13-8-7-11-4-1-2-5-12(11)10-13/h1-2,4-5,10,14,17H,3,6-9H2,(H,16,18)
InChIKeyGREZJRPYIUYQLX-UHFFFAOYSA-N
MW322.39 g/mol
LogP1.10
Rot. Bonds4

About N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide

N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide (PubChem CID 87026861) has the molecular formula C15H18N2O4S and a molecular weight of 322.39 g/mol. Its IUPAC name is N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide.

Molecular Properties

Compound NameN'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide
PubChem CID87026861
Molecular FormulaC15H18N2O4S
Molecular Weight322.39 g/mol
Exact Mass322.10
IUPAC NameN'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide
SMILESO=C(NNS(=O)(=O)C1=Cc2ccccc2CC1)C1CCCO1
InChIInChI=1S/C15H18N2O4S/c18-15(14-6-3-9-21-14)16-17-22(19,20)13-8-7-11-4-1-2-5-12(11)10-13/h1-2,4-5,10,14,17H,3,6-9H2,(H,16,18)
InChIKeyGREZJRPYIUYQLX-UHFFFAOYSA-N
XLogP1.10
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-N'-(4-methylbenzoyl)oxolane-2-carbohydrazide
CID 40870131
N-[4-(benzoylsulfamoyl)phenyl]oxolane-2-carboxamide
CID 2970623
N'-[(2S)-oxolane-2-carbonyl]pyridine-2-carbohydrazide
CID 7405767
N-phenyloxolane-2-carboxamide
CID 3453643
(2S)-N-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]oxolane-2-carboxamide
CID 1246029
3-cyclopropyl-N'-[(2S)-oxolane-2-carbonyl]quinoxaline-2-carbohydrazide
CID 166235775
N-(4-anilinophenyl)oxolane-2-carboxamide
CID 4690010
N'-(2-methylbenzoyl)oxolane-2-carbohydrazide
CID 51164592
N-(5,6,7,8-tetrahydronaphthalen-1-yl)oxolane-2-carboxamide
CID 42904447
N-(4-benzoylphenyl)oxolane-2-carboxamide
CID 11839657
(2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide
CID 95233016
(2S)-N-[(1R)-1-(trifluoromethyl)-2,3-dihydroinden-1-yl]oxolane-2-carboxamide
CID 124885171

Frequently Asked Questions

What is the IUPAC name of N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide?
The IUPAC name of N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide (CID 87026861) is N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide.
What is the SMILES notation for N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide?
The canonical SMILES for N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide is O=C(NNS(=O)(=O)C1=Cc2ccccc2CC1)C1CCCO1.
What is the InChIKey of N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide?
The InChIKey is GREZJRPYIUYQLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4S/c18-15(14-6-3-9-21-14)16-17-22(19,20)13-8-7-11-4-1-2-5-12(11)10-13/h1-2,4-5,10,14,17H,3,6-9H2,(H,16,18).
What are the key properties of N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide?
N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide has a molecular weight of 322.39 g/mol, XLogP of 1.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3,4-dihydronaphthalen-2-ylsulfonyl)oxolane-2-carbohydrazide is sourced from PubChem (CID 87026861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).