N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide

C15H22N2O3S — CID 71997817

IUPACN-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide
SMILESO=S(=O)(CC1CCOCC1)N(Cc1cccnc1)C1CC1
InChIInChI=1S/C15H22N2O3S/c18-21(19,12-13-5-8-20-9-6-13)17(15-3-4-15)11-14-2-1-7-16-10-14/h1-2,7,10,13,15H,3-6,8-9,11-12H2
InChIKeyVXQHIWMSGQRHEZ-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.80
Rot. Bonds6

About N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide

N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide (PubChem CID 71997817) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide
PubChem CID71997817
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide
SMILESO=S(=O)(CC1CCOCC1)N(Cc1cccnc1)C1CC1
InChIInChI=1S/C15H22N2O3S/c18-21(19,12-13-5-8-20-9-6-13)17(15-3-4-15)11-14-2-1-7-16-10-14/h1-2,7,10,13,15H,3-6,8-9,11-12H2
InChIKeyVXQHIWMSGQRHEZ-UHFFFAOYSA-N
XLogP1.80
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(oxan-4-ylmethyl)pyridine;hydrochloride
CID 175648027
methyl 4-[cyclopropyl(pyridin-3-ylmethyl)sulfamoyl]butanoate
CID 61460740
2-chloro-N-cyclopropyl-N-(pyridin-3-ylmethyl)pyridine-3-sulfonamide
CID 61042316
N-cyclopropyl-1-[(3R)-oxolan-3-yl]-N-(thiophen-3-ylmethyl)methanesulfonamide
CID 95317371
1-N,4-N-dicyclopropyl-4-N-(pyridin-3-ylmethyl)benzene-1,4-disulfonamide
CID 55564950
N-cyclopropyl-4-ethoxy-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 51204434
N-[[(3S)-oxolan-3-yl]methyl]-N-(pyridin-3-ylmethyl)ethanamine
CID 95285929
N-cyclopropyl-2,3-dioxo-N-(pyridin-3-ylmethyl)-1,4-dihydroquinoxaline-6-sulfonamide
CID 55511974
cyclohexyl-[4-[oxan-4-yl(pyridin-3-ylmethyl)amino]piperidin-1-yl]methanone
CID 91916226
N-ethyl-N-(pyridin-3-ylmethyl)ethanesulfonamide
CID 174517903
4-N-ethyl-4-N-(pyridin-3-ylmethyl)cyclohexane-1,4-diamine
CID 79116173
lithium N,N-bis(pyridin-3-ylmethyl)sulfamate
CID 153347507

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide?
The IUPAC name of N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide (CID 71997817) is N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide.
What is the SMILES notation for N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide?
The canonical SMILES for N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide is O=S(=O)(CC1CCOCC1)N(Cc1cccnc1)C1CC1.
What is the InChIKey of N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide?
The InChIKey is VXQHIWMSGQRHEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c18-21(19,12-13-5-8-20-9-6-13)17(15-3-4-15)11-14-2-1-7-16-10-14/h1-2,7,10,13,15H,3-6,8-9,11-12H2.
What are the key properties of N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide?
N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide has a molecular weight of 310.42 g/mol, XLogP of 1.80, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(oxan-4-yl)-N-(pyridin-3-ylmethyl)methanesulfonamide is sourced from PubChem (CID 71997817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).