6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide

C19H34N4O2S — CID 55827762

IUPAC6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide
SMILESCC1CCN(CCNc2ccc(S(=O)(=O)N(C(C)C)C(C)C)cn2)CC1
InChIInChI=1S/C19H34N4O2S/c1-15(2)23(16(3)4)26(24,25)18-6-7-19(21-14-18)20-10-13-22-11-8-17(5)9-12-22/h6-7,14-17H,8-13H2,1-5H3,(H,20,21)
InChIKeyNPWMJVZZDMGYDZ-UHFFFAOYSA-N
MW382.57 g/mol
LogP3.03
Rot. Bonds8

About 6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide

6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide (PubChem CID 55827762) has the molecular formula C19H34N4O2S and a molecular weight of 382.57 g/mol. Its IUPAC name is 6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide
PubChem CID55827762
Molecular FormulaC19H34N4O2S
Molecular Weight382.57 g/mol
Exact Mass382.24
IUPAC Name6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide
SMILESCC1CCN(CCNc2ccc(S(=O)(=O)N(C(C)C)C(C)C)cn2)CC1
InChIInChI=1S/C19H34N4O2S/c1-15(2)23(16(3)4)26(24,25)18-6-7-19(21-14-18)20-10-13-22-11-8-17(5)9-12-22/h6-7,14-17H,8-13H2,1-5H3,(H,20,21)
InChIKeyNPWMJVZZDMGYDZ-UHFFFAOYSA-N
XLogP3.03
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.57
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-tert-butyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine
CID 107874553
6-[2-(azepan-1-yl)ethylamino]-N-methylpyridine-3-sulfonamide
CID 133351391
6-(2-piperazin-1-ylethylamino)pyridine-3-sulfonamide
CID 43607786
4-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]-5-nitropyridin-2-amine
CID 79173443
N-ethyl-5-(4-methylazepan-1-yl)sulfonylpyridin-2-amine
CID 63626896
N,N-dimethyl-6-(2-propan-2-yloxyethylamino)pyridine-3-sulfonamide
CID 104577001
6-(cyclohex-3-en-1-ylamino)-N,N-di(propan-2-yl)pyridine-3-sulfonamide
CID 133322671
6-(cyclopropylmethylamino)-N,N-dimethylpyridine-3-sulfonamide
CID 113234561
N,N-dimethyl-6-[3-[methyl(propan-2-yl)amino]propylamino]pyridine-3-sulfonamide
CID 106048482
N-methyl-N-pentan-2-yl-6-(propylamino)pyridine-3-sulfonamide
CID 62147366
N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-3-sulfonamide
CID 63940107
N-butyl-N-cyclopropyl-6-(propylamino)pyridine-3-sulfonamide
CID 62156743

Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide?
The IUPAC name of 6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide (CID 55827762) is 6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide?
The canonical SMILES for 6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide is CC1CCN(CCNc2ccc(S(=O)(=O)N(C(C)C)C(C)C)cn2)CC1.
What is the InChIKey of 6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide?
The InChIKey is NPWMJVZZDMGYDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N4O2S/c1-15(2)23(16(3)4)26(24,25)18-6-7-19(21-14-18)20-10-13-22-11-8-17(5)9-12-22/h6-7,14-17H,8-13H2,1-5H3,(H,20,21).
What are the key properties of 6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide?
6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide has a molecular weight of 382.57 g/mol, XLogP of 3.03, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-methylpiperidin-1-yl)ethylamino]-N,N-di(propan-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 55827762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).