N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide

C21H22N2O4S — CID 1367681

IUPACN-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide
SMILESCS(=O)(=O)N(Cc1ccco1)C[C@@H](O)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C21H22N2O4S/c1-28(25,26)22(15-17-7-6-12-27-17)13-16(24)14-23-20-10-4-2-8-18(20)19-9-3-5-11-21(19)23/h2-12,16,24H,13-15H2,1H3/t16-/m1/s1
InChIKeyOQAFDLPAPSSOHY-MRXNPFEDSA-N
MW398.48 g/mol
LogP3.21
Rot. Bonds7

About N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide

N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide (PubChem CID 1367681) has the molecular formula C21H22N2O4S and a molecular weight of 398.48 g/mol. Its IUPAC name is N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide.

Molecular Properties

Compound NameN-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide
PubChem CID1367681
Molecular FormulaC21H22N2O4S
Molecular Weight398.48 g/mol
Exact Mass398.13
IUPAC NameN-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide
SMILESCS(=O)(=O)N(Cc1ccco1)C[C@@H](O)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C21H22N2O4S/c1-28(25,26)22(15-17-7-6-12-27-17)13-16(24)14-23-20-10-4-2-8-18(20)19-9-3-5-11-21(19)23/h2-12,16,24H,13-15H2,1H3/t16-/m1/s1
InChIKeyOQAFDLPAPSSOHY-MRXNPFEDSA-N
XLogP3.21
TPSA75.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.48
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide 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

N-[(2R)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)-4-methylbenzenesulfonamide
CID 983501
N-[(2R)-3-(fluoren-9-ylideneamino)oxy-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide
CID 2151835
N-(3-carbazol-9-yl-2-hydroxypropyl)-3,3,3-trifluoro-N-(furan-2-ylmethyl)propane-1-sulfinamide
CID 135295539
N-[(2R)-3-carbazol-9-yl-2-hydroxypropyl]-N-ethyl-4-methylbenzenesulfonamide
CID 983506
N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-ethyl-4-fluorobenzenesulfonamide
CID 1300584
4-chloro-N-(furan-2-ylmethyl)-N-[2-hydroxy-3-[3-[(E)-hydroxyiminomethyl]indol-1-yl]propyl]benzenesulfonamide
CID 18590176
N-(3-carbazol-9-yl-2-hydroxypropyl)-N-(1-formyl-4H-naphthalen-1-yl)methanesulfonamide
CID 135284901
(2S)-1-carbazol-9-yl-3-(dipropylamino)propan-2-ol
CID 726400
N-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)methanesulfonamide
CID 889054
N-(3-carbazol-9-yl-2-hydroxypropyl)-N-ethylmethanesulfinamide
CID 135295654
N-(3-carbazol-9-yl-2-hydroxypropyl)-N-(2-methoxyethyl)-4-methylbenzenesulfonamide
CID 4282252
3-[[(2R)-3-carbazol-9-yl-2-hydroxypropyl]-(4-methylphenyl)sulfonylamino]propanoic acid
CID 41476223

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide?
The IUPAC name of N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide (CID 1367681) is N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide.
What is the SMILES notation for N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide?
The canonical SMILES for N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide is CS(=O)(=O)N(Cc1ccco1)C[C@@H](O)Cn1c2ccccc2c2ccccc21.
What is the InChIKey of N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide?
The InChIKey is OQAFDLPAPSSOHY-MRXNPFEDSA-N. The full InChI is InChI=1S/C21H22N2O4S/c1-28(25,26)22(15-17-7-6-12-27-17)13-16(24)14-23-20-10-4-2-8-18(20)19-9-3-5-11-21(19)23/h2-12,16,24H,13-15H2,1H3/t16-/m1/s1.
What are the key properties of N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide?
N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide has a molecular weight of 398.48 g/mol, XLogP of 3.21, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-3-carbazol-9-yl-2-hydroxypropyl]-N-(furan-2-ylmethyl)methanesulfonamide is sourced from PubChem (CID 1367681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).