N-(4-azido-2-methoxyphenyl)methanesulfonamide

C8H10N4O3S — CID 151163168

IUPACN-(4-azido-2-methoxyphenyl)methanesulfonamide
SMILESCOc1cc(N=[N+]=[N-])ccc1NS(C)(=O)=O
InChIInChI=1S/C8H10N4O3S/c1-15-8-5-6(10-12-9)3-4-7(8)11-16(2,13)14/h3-5,11H,1-2H3
InChIKeyNARRORWRAFRZHB-UHFFFAOYSA-N
MW242.26 g/mol
LogP2.01
Rot. Bonds4

About N-(4-azido-2-methoxyphenyl)methanesulfonamide

N-(4-azido-2-methoxyphenyl)methanesulfonamide (PubChem CID 151163168) has the molecular formula C8H10N4O3S and a molecular weight of 242.26 g/mol. Its IUPAC name is N-(4-azido-2-methoxyphenyl)methanesulfonamide.

Molecular Properties

Compound NameN-(4-azido-2-methoxyphenyl)methanesulfonamide
PubChem CID151163168
Molecular FormulaC8H10N4O3S
Molecular Weight242.26 g/mol
Exact Mass242.05
IUPAC NameN-(4-azido-2-methoxyphenyl)methanesulfonamide
SMILESCOc1cc(N=[N+]=[N-])ccc1NS(C)(=O)=O
InChIInChI=1S/C8H10N4O3S/c1-15-8-5-6(10-12-9)3-4-7(8)11-16(2,13)14/h3-5,11H,1-2H3
InChIKeyNARRORWRAFRZHB-UHFFFAOYSA-N
XLogP2.01
TPSA104.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.26
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

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CID 151973375
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CID 54764214
N-(4-amino-2,5-dimethoxyphenyl)methanesulfonamide
CID 57266401
2-bromo-2,2-difluoro-N-[4-(methanesulfonamido)-3-methoxyphenyl]acetamide
CID 51132083
N-(6-methoxy-1,3-dimethyl-2-oxobenzimidazol-5-yl)methanesulfonamide
CID 22434010
N-(2-formyl-4-methoxyphenyl)methanesulfonamide
CID 131493986
dimethyl (E)-2-[4-(methanesulfonamido)-3-methoxyanilino]but-2-enedioate
CID 168565971
N-(4-methoxy-2-methylphenyl)methanesulfonamide
CID 15851883
N-[4-(2,3-dihydro-1H-inden-2-ylamino)-2-methoxyphenyl]methanesulfonamide
CID 75498368
2-amino-N-[4-(methanesulfonamido)-3-methoxyphenyl]-3-methoxypropanamide
CID 120985632
methyl 3-(methanesulfonamido)-4-methoxybenzoate
CID 5303011

Frequently Asked Questions

What is the IUPAC name of N-(4-azido-2-methoxyphenyl)methanesulfonamide?
The IUPAC name of N-(4-azido-2-methoxyphenyl)methanesulfonamide (CID 151163168) is N-(4-azido-2-methoxyphenyl)methanesulfonamide.
What is the SMILES notation for N-(4-azido-2-methoxyphenyl)methanesulfonamide?
The canonical SMILES for N-(4-azido-2-methoxyphenyl)methanesulfonamide is COc1cc(N=[N+]=[N-])ccc1NS(C)(=O)=O.
What is the InChIKey of N-(4-azido-2-methoxyphenyl)methanesulfonamide?
The InChIKey is NARRORWRAFRZHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O3S/c1-15-8-5-6(10-12-9)3-4-7(8)11-16(2,13)14/h3-5,11H,1-2H3.
What are the key properties of N-(4-azido-2-methoxyphenyl)methanesulfonamide?
N-(4-azido-2-methoxyphenyl)methanesulfonamide has a molecular weight of 242.26 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-azido-2-methoxyphenyl)methanesulfonamide is sourced from PubChem (CID 151163168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).