N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine

C19H37N3O2S — CID 167707491

IUPACN-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine
SMILESC.CC(C)(N)c1cccnc1.CC(C)(NS(C)(=O)=O)C1CCCCC1
InChIInChI=1S/C10H21NO2S.C8H12N2.CH4/c1-10(2,11-14(3,12)13)9-7-5-4-6-8-9;1-8(2,9)7-4-3-5-10-6-7;/h9,11H,4-8H2,1-3H3;3-6H,9H2,1-2H3;1H4
InChIKeyZHYXDVXPUSZISO-UHFFFAOYSA-N
MW371.59 g/mol
LogP3.81
Rot. Bonds4

About N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine

N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine (PubChem CID 167707491) has the molecular formula C19H37N3O2S and a molecular weight of 371.59 g/mol. Its IUPAC name is N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine.

Molecular Properties

Compound NameN-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine
PubChem CID167707491
Molecular FormulaC19H37N3O2S
Molecular Weight371.59 g/mol
Exact Mass371.26
IUPAC NameN-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine
SMILESC.CC(C)(N)c1cccnc1.CC(C)(NS(C)(=O)=O)C1CCCCC1
InChIInChI=1S/C10H21NO2S.C8H12N2.CH4/c1-10(2,11-14(3,12)13)9-7-5-4-6-8-9;1-8(2,9)7-4-3-5-10-6-7;/h9,11H,4-8H2,1-3H3;3-6H,9H2,1-2H3;1H4
InChIKeyZHYXDVXPUSZISO-UHFFFAOYSA-N
XLogP3.81
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.59
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine with MolForge

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Related Compounds

3-(2-cyclohexylpropan-2-yl)pyridine
CID 91076672
dicyclohexyl(pyridin-3-yl)methanol
CID 70631118
1-piperidin-3-yl-1-pyridin-3-ylethanol
CID 63585901
bromo 2-(methanesulfonamido)-2-phenyl-2-pyridin-3-ylacetate
CID 174754378
2-cyclohexyl-1-pyridin-3-ylpropan-2-ol
CID 114795036
N-(2-amino-2-methylpropyl)pyridine-3-sulfonamide
CID 115303456
1,3-dicyclopentyl-2-pyridin-3-ylpropan-2-ol
CID 21420913
(1S,4R)-N-(2-methyl-2-pyridin-3-ylpropyl)bicyclo[2.2.1]heptane-2-sulfonamide
CID 128779870
N-(2-cyclohexyl-1-hydroxypropan-2-yl)pyridine-3-carboxamide
CID 91660588
(2S)-2-pyridin-3-ylbutan-2-amine
CID 93358668
methyl 2-methyl-2-pyridin-3-ylpropanoate
CID 54537815
(2S)-2-amino-2-pyridin-3-ylpropanoic acid;hydrochloride
CID 71485674

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine?
The IUPAC name of N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine (CID 167707491) is N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine.
What is the SMILES notation for N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine?
The canonical SMILES for N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine is C.CC(C)(N)c1cccnc1.CC(C)(NS(C)(=O)=O)C1CCCCC1.
What is the InChIKey of N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine?
The InChIKey is ZHYXDVXPUSZISO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S.C8H12N2.CH4/c1-10(2,11-14(3,12)13)9-7-5-4-6-8-9;1-8(2,9)7-4-3-5-10-6-7;/h9,11H,4-8H2,1-3H3;3-6H,9H2,1-2H3;1H4.
What are the key properties of N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine?
N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine has a molecular weight of 371.59 g/mol, XLogP of 3.81, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylpropan-2-yl)methanesulfonamide;methane;2-pyridin-3-ylpropan-2-amine is sourced from PubChem (CID 167707491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).