N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide

C14H22N2O2S — CID 103561544

IUPACN-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide
SMILESCC(C)C1CC(Nc2ccccc2NS(C)(=O)=O)C1
InChIInChI=1S/C14H22N2O2S/c1-10(2)11-8-12(9-11)15-13-6-4-5-7-14(13)16-19(3,17)18/h4-7,10-12,15-16H,8-9H2,1-3H3
InChIKeyRAZMPNGQHHMRAO-UHFFFAOYSA-N
MW282.41 g/mol
LogP2.90
Rot. Bonds5

About N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide

N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide (PubChem CID 103561544) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide
PubChem CID103561544
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC NameN-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide
SMILESCC(C)C1CC(Nc2ccccc2NS(C)(=O)=O)C1
InChIInChI=1S/C14H22N2O2S/c1-10(2)11-8-12(9-11)15-13-6-4-5-7-14(13)16-19(3,17)18/h4-7,10-12,15-16H,8-9H2,1-3H3
InChIKeyRAZMPNGQHHMRAO-UHFFFAOYSA-N
XLogP2.90
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide?
The IUPAC name of N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide (CID 103561544) is N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide.
What is the SMILES notation for N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide?
The canonical SMILES for N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide is CC(C)C1CC(Nc2ccccc2NS(C)(=O)=O)C1.
What is the InChIKey of N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide?
The InChIKey is RAZMPNGQHHMRAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-10(2)11-8-12(9-11)15-13-6-4-5-7-14(13)16-19(3,17)18/h4-7,10-12,15-16H,8-9H2,1-3H3.
What are the key properties of N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide?
N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide has a molecular weight of 282.41 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(3-propan-2-ylcyclobutyl)amino]phenyl]methanesulfonamide is sourced from PubChem (CID 103561544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).