N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide

C10H16N2O2S — CID 176628991

IUPACN,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide
SMILESCC(C)c1cnccc1S(=O)(=O)N(C)C
InChIInChI=1S/C10H16N2O2S/c1-8(2)9-7-11-6-5-10(9)15(13,14)12(3)4/h5-8H,1-4H3
InChIKeyMPHPSFFMVYADQT-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.46
Rot. Bonds3

About N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide

N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide (PubChem CID 176628991) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide
PubChem CID176628991
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC NameN,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide
SMILESCC(C)c1cnccc1S(=O)(=O)N(C)C
InChIInChI=1S/C10H16N2O2S/c1-8(2)9-7-11-6-5-10(9)15(13,14)12(3)4/h5-8H,1-4H3
InChIKeyMPHPSFFMVYADQT-UHFFFAOYSA-N
XLogP1.46
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(Trifluoromethyl)pyridine-2-sulfonamide
CID 13910921
4-Pyridineethanesulfonic acid
CID 96722
1-Tosylpyrrole
CID 640087
4-Methyl-N-pyridin-2-ylmethyl-benzenesulfonamide
CID 731623
4-Methyl-N-pyridin-3-YL-benzenesulfonamide
CID 757406
Pyridine, 4-[2-[(4-methylphenyl)sulfonyl]ethyl]-
CID 571666
BM-960102
CID 819349
2-Fluoro-1-methylpyridinium p-toluenesulfonate
CID 171631
4-Pyridin-3-ylbenzenesulfonamide
CID 110453853
2,4,6-trimethyl-N-(3-pyridinylmethyl)benzenesulfonamide
CID 676052
4-fluoro-N-(2-pyridin-4-ylethyl)benzenesulfonamide
CID 688002
4-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 795996

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide?
The IUPAC name of N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide (CID 176628991) is N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide.
What is the SMILES notation for N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide?
The canonical SMILES for N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide is CC(C)c1cnccc1S(=O)(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide?
The InChIKey is MPHPSFFMVYADQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-8(2)9-7-11-6-5-10(9)15(13,14)12(3)4/h5-8H,1-4H3.
What are the key properties of N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide?
N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide has a molecular weight of 228.32 g/mol, XLogP of 1.46, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-propan-2-ylpyridine-4-sulfonamide is sourced from PubChem (CID 176628991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).