N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide

C14H21N3O2S — CID 103306367

IUPACN-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)NCC(C1CC1)C1CC1
InChIInChI=1S/C14H21N3O2S/c1-15-13-3-2-8-16-14(13)20(18,19)17-9-12(10-4-5-10)11-6-7-11/h2-3,8,10-12,15,17H,4-7,9H2,1H3
InChIKeyVZYHLYZYMJEYRF-UHFFFAOYSA-N
MW295.41 g/mol
LogP1.84
Rot. Bonds7

About N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide

N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide (PubChem CID 103306367) has the molecular formula C14H21N3O2S and a molecular weight of 295.41 g/mol. Its IUPAC name is N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide
PubChem CID103306367
Molecular FormulaC14H21N3O2S
Molecular Weight295.41 g/mol
Exact Mass295.14
IUPAC NameN-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)NCC(C1CC1)C1CC1
InChIInChI=1S/C14H21N3O2S/c1-15-13-3-2-8-16-14(13)20(18,19)17-9-12(10-4-5-10)11-6-7-11/h2-3,8,10-12,15,17H,4-7,9H2,1H3
InChIKeyVZYHLYZYMJEYRF-UHFFFAOYSA-N
XLogP1.84
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclobutyl-3-(methylamino)pyridine-2-sulfonamide
CID 103305744
3-(methylamino)-N-[(2-methylcyclohexyl)methyl]pyridine-2-sulfonamide
CID 103305012
3-(methylamino)-N-pyrimidin-2-ylpyridine-2-sulfonamide
CID 103303450
N-(2-hydroxycyclohexyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103305739
N-(3,5-dimethylcyclohexyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103306280
N-(3-ethyl-2-methylcyclopentyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103306293
N-[2-(4-hydroxyphenyl)ethyl]-3-(methylamino)pyridine-2-sulfonamide
CID 103305004
2-[[3-(methylamino)-2-pyridinyl]sulfonylamino]ethyl carbamate
CID 103306938
N-(2,2-difluoroethyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103301882
N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304016
3-(methylamino)-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyridine-2-sulfonamide
CID 106407931
N-(1-ethylpiperidin-3-yl)-3-(methylamino)pyridine-2-sulfonamide
CID 103305212

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide (CID 103306367) is N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide is CNc1cccnc1S(=O)(=O)NCC(C1CC1)C1CC1.
What is the InChIKey of N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide?
The InChIKey is VZYHLYZYMJEYRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2S/c1-15-13-3-2-8-16-14(13)20(18,19)17-9-12(10-4-5-10)11-6-7-11/h2-3,8,10-12,15,17H,4-7,9H2,1H3.
What are the key properties of N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide?
N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide has a molecular weight of 295.41 g/mol, XLogP of 1.84, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dicyclopropylethyl)-3-(methylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103306367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).