N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine

C14H24N2O3S2 — CID 47034992

IUPACN-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine
SMILESCC(C)N(C)S(=O)(=O)N(Cc1cccs1)CC1CCCO1
InChIInChI=1S/C14H24N2O3S2/c1-12(2)15(3)21(17,18)16(10-13-6-4-8-19-13)11-14-7-5-9-20-14/h5,7,9,12-13H,4,6,8,10-11H2,1-3H3
InChIKeyIZNCGHQOVCYQRO-UHFFFAOYSA-N
MW332.49 g/mol
LogP2.31
Rot. Bonds7

About N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine

N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine (PubChem CID 47034992) has the molecular formula C14H24N2O3S2 and a molecular weight of 332.49 g/mol. Its IUPAC name is N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine.

Molecular Properties

Compound NameN-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine
PubChem CID47034992
Molecular FormulaC14H24N2O3S2
Molecular Weight332.49 g/mol
Exact Mass332.12
IUPAC NameN-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine
SMILESCC(C)N(C)S(=O)(=O)N(Cc1cccs1)CC1CCCO1
InChIInChI=1S/C14H24N2O3S2/c1-12(2)15(3)21(17,18)16(10-13-6-4-8-19-13)11-14-7-5-9-20-14/h5,7,9,12-13H,4,6,8,10-11H2,1-3H3
InChIKeyIZNCGHQOVCYQRO-UHFFFAOYSA-N
XLogP2.31
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine?
The IUPAC name of N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine (CID 47034992) is N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine.
What is the SMILES notation for N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine?
The canonical SMILES for N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine is CC(C)N(C)S(=O)(=O)N(Cc1cccs1)CC1CCCO1.
What is the InChIKey of N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine?
The InChIKey is IZNCGHQOVCYQRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3S2/c1-12(2)15(3)21(17,18)16(10-13-6-4-8-19-13)11-14-7-5-9-20-14/h5,7,9,12-13H,4,6,8,10-11H2,1-3H3.
What are the key properties of N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine?
N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine has a molecular weight of 332.49 g/mol, XLogP of 2.31, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)sulfamoyl]propan-2-amine is sourced from PubChem (CID 47034992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).