N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide

C17H20N2O3S — CID 2947704

IUPACN-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide
SMILESCN(CC(O)Cn1c2ccccc2c2ccccc21)S(C)(=O)=O
InChIInChI=1S/C17H20N2O3S/c1-18(23(2,21)22)11-13(20)12-19-16-9-5-3-7-14(16)15-8-4-6-10-17(15)19/h3-10,13,20H,11-12H2,1-2H3
InChIKeySYCWYYGVBFXMIO-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.05
Rot. Bonds5

About N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide

N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide (PubChem CID 2947704) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide
PubChem CID2947704
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC NameN-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide
SMILESCN(CC(O)Cn1c2ccccc2c2ccccc21)S(C)(=O)=O
InChIInChI=1S/C17H20N2O3S/c1-18(23(2,21)22)11-13(20)12-19-16-9-5-3-7-14(16)15-8-4-6-10-17(15)19/h3-10,13,20H,11-12H2,1-2H3
InChIKeySYCWYYGVBFXMIO-UHFFFAOYSA-N
XLogP2.05
TPSA62.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

9H-Carbazole-9-ethanol, alpha-(1-piperidinylmethyl)-
CID 56210
9H-Carbazole-9-methanol
CID 75480
1-(9H-Carbazol-9-yl)-3-(morpholin-4-yl)propan-2-ol
CID 56212
1H-Pyrazino(3,2,1-jk)carbazole, 2,4,5,6-tetrahydro-8-phenyl-, monomethanesulfonate
CID 3077444
3,6-Dibromo-alpha-((dimethylamino)methyl)-9H-carbazole-9-ethanol
CID 2775510
N-[3-(9H-carbazol-9-yl)-2-hydroxypropyl]-N-phenylmethanesulfonamide
CID 2879611
N-[3-(9H-carbazol-9-yl)-2-hydroxypropyl]-N-(4-fluorophenyl)methanesulfonamide
CID 2953180
1-(Cyclohexylamino)-3-(6-methyl-3,4-dihydro-1H-carbazol-9(2H)-YL)propan-2-OL
CID 961704
(S)-wiskostatin
CID 448668
1-[4-(3-Carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]ethanone
CID 2899994
1-(2,3-dimethyl-1H-indol-1-yl)-3-(4-methylpiperazin-1-yl)propan-2-ol
CID 4229169
alpha-((Dipropylamino)methyl)-9H-carbazole-9-ethanol
CID 2802130

Frequently Asked Questions

What is the IUPAC name of N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide?
The IUPAC name of N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide (CID 2947704) is N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide.
What is the SMILES notation for N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide?
The canonical SMILES for N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide is CN(CC(O)Cn1c2ccccc2c2ccccc21)S(C)(=O)=O.
What is the InChIKey of N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide?
The InChIKey is SYCWYYGVBFXMIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-18(23(2,21)22)11-13(20)12-19-16-9-5-3-7-14(16)15-8-4-6-10-17(15)19/h3-10,13,20H,11-12H2,1-2H3.
What are the key properties of N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide?
N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide has a molecular weight of 332.43 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-carbazol-9-yl-2-hydroxypropyl)-N-methylmethanesulfonamide is sourced from PubChem (CID 2947704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).