propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate

C11H23N3O5S — CID 106610356

IUPACpropan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate
SMILESCC(C)OC(=O)NS(=O)(=O)N(CCO)CC1CCCN1
InChIInChI=1S/C11H23N3O5S/c1-9(2)19-11(16)13-20(17,18)14(6-7-15)8-10-4-3-5-12-10/h9-10,12,15H,3-8H2,1-2H3,(H,13,16)
InChIKeyJQXWIKNLZDUJNI-UHFFFAOYSA-N
MW309.39 g/mol
LogP-0.59
Rot. Bonds7

About propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate

propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate (PubChem CID 106610356) has the molecular formula C11H23N3O5S and a molecular weight of 309.39 g/mol. Its IUPAC name is propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate.

Molecular Properties

Compound Namepropan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate
PubChem CID106610356
Molecular FormulaC11H23N3O5S
Molecular Weight309.39 g/mol
Exact Mass309.14
IUPAC Namepropan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate
SMILESCC(C)OC(=O)NS(=O)(=O)N(CCO)CC1CCCN1
InChIInChI=1S/C11H23N3O5S/c1-9(2)19-11(16)13-20(17,18)14(6-7-15)8-10-4-3-5-12-10/h9-10,12,15H,3-8H2,1-2H3,(H,13,16)
InChIKeyJQXWIKNLZDUJNI-UHFFFAOYSA-N
XLogP-0.59
TPSA107.97 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.39
LogP ≤ 5-0.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate 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

ethyl N-[2-methoxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate
CID 106609811
propan-2-yl N-[piperidin-4-ylmethyl(propyl)sulfamoyl]carbamate
CID 114465117
propan-2-yl N-[cyclopentyl(2-hydroxyethyl)sulfamoyl]carbamate
CID 114464161
ethyl N-[ethyl(piperidin-2-ylmethyl)sulfamoyl]carbamate
CID 106630320
propan-2-yl N-[ethyl(piperidin-4-ylmethyl)sulfamoyl]carbamate
CID 114465115
propan-2-yl N-[2-hydroxyethyl(methyl)sulfamoyl]carbamate
CID 114464122
N-(2-hydroxyethyl)-3,5-dimethyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106610223
propan-2-yl N-cyclopropyl-N-(pyrrolidin-2-ylmethyl)carbamate
CID 106599450
2-[1-cyclopropylethyl(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106606811
2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-N-methylpropanamide
CID 106618297
2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-N-(1-methoxypropan-2-yl)acetamide
CID 106617890
N-(2-hydroxyethyl)-4-methoxy-N-(pyrrolidin-2-ylmethyl)pentanamide
CID 106612775

Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate?
The IUPAC name of propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate (CID 106610356) is propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate.
What is the SMILES notation for propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate?
The canonical SMILES for propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate is CC(C)OC(=O)NS(=O)(=O)N(CCO)CC1CCCN1.
What is the InChIKey of propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate?
The InChIKey is JQXWIKNLZDUJNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O5S/c1-9(2)19-11(16)13-20(17,18)14(6-7-15)8-10-4-3-5-12-10/h9-10,12,15H,3-8H2,1-2H3,(H,13,16).
What are the key properties of propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate?
propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate has a molecular weight of 309.39 g/mol, XLogP of -0.59, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)sulfamoyl]carbamate is sourced from PubChem (CID 106610356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).