N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide

C14H18N2O2S — CID 113096702

IUPACN-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide
SMILESCn1c2c(c3ccccc31)CC(NS(C)(=O)=O)CC2
InChIInChI=1S/C14H18N2O2S/c1-16-13-6-4-3-5-11(13)12-9-10(7-8-14(12)16)15-19(2,17)18/h3-6,10,15H,7-9H2,1-2H3
InChIKeyUAWDTXOTTMBRAP-UHFFFAOYSA-N
MW278.38 g/mol
LogP1.58
Rot. Bonds2

About N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide

N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide (PubChem CID 113096702) has the molecular formula C14H18N2O2S and a molecular weight of 278.38 g/mol. Its IUPAC name is N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide
PubChem CID113096702
Molecular FormulaC14H18N2O2S
Molecular Weight278.38 g/mol
Exact Mass278.11
IUPAC NameN-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide
SMILESCn1c2c(c3ccccc31)CC(NS(C)(=O)=O)CC2
InChIInChI=1S/C14H18N2O2S/c1-16-13-6-4-3-5-11(13)12-9-10(7-8-14(12)16)15-19(2,17)18/h3-6,10,15H,7-9H2,1-2H3
InChIKeyUAWDTXOTTMBRAP-UHFFFAOYSA-N
XLogP1.58
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.38
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)benzenesulfonamide
CID 113096741
N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)propanamide
CID 113096632
N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)-2-phenylacetamide
CID 113096664
9-methyl-1,2,3,4-tetrahydrocarbazole-3-carboxamide
CID 84613056
ethane;9-methyl-1,2,3,4-tetrahydrocarbazol-3-ol
CID 145187913
4-methoxy-N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)benzamide
CID 113096656
methyl 9-methyl-1,2,3,4-tetrahydrocarbazole-3-carboxylate
CID 84613051
(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanol
CID 140999060
N-(2,3,4,9-tetrahydro-1H-carbazol-3-yl)methanesulfonamide
CID 113096584
2,6-dimethyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole
CID 170405716
sodium;hydride;3-[3-[(4-methylphenyl)sulfonylamino]-1,2,3,4-tetrahydrocarbazol-9-yl]propanoic acid
CID 173377940
methyl 3-[3-[(4-fluorophenyl)sulfonylamino]-1,2,3,4-tetrahydrocarbazol-9-yl]propanoate
CID 14687304

Frequently Asked Questions

What is the IUPAC name of N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide?
The IUPAC name of N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide (CID 113096702) is N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide.
What is the SMILES notation for N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide?
The canonical SMILES for N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide is Cn1c2c(c3ccccc31)CC(NS(C)(=O)=O)CC2.
What is the InChIKey of N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide?
The InChIKey is UAWDTXOTTMBRAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2S/c1-16-13-6-4-3-5-11(13)12-9-10(7-8-14(12)16)15-19(2,17)18/h3-6,10,15H,7-9H2,1-2H3.
What are the key properties of N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide?
N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide has a molecular weight of 278.38 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-methyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanesulfonamide is sourced from PubChem (CID 113096702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).