N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide

C11H24N2O4S — CID 43573547

IUPACN-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide
SMILESCCCS(=O)(=O)NC(C)C(=O)N(CCO)C(C)C
InChIInChI=1S/C11H24N2O4S/c1-5-8-18(16,17)12-10(4)11(15)13(6-7-14)9(2)3/h9-10,12,14H,5-8H2,1-4H3
InChIKeyBSBIRZUTDBHZHM-UHFFFAOYSA-N
MW280.39 g/mol
LogP-0.07
Rot. Bonds8

About N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide

N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide (PubChem CID 43573547) has the molecular formula C11H24N2O4S and a molecular weight of 280.39 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide
PubChem CID43573547
Molecular FormulaC11H24N2O4S
Molecular Weight280.39 g/mol
Exact Mass280.15
IUPAC NameN-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide
SMILESCCCS(=O)(=O)NC(C)C(=O)N(CCO)C(C)C
InChIInChI=1S/C11H24N2O4S/c1-5-8-18(16,17)12-10(4)11(15)13(6-7-14)9(2)3/h9-10,12,14H,5-8H2,1-4H3
InChIKeyBSBIRZUTDBHZHM-UHFFFAOYSA-N
XLogP-0.07
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[propan-2-yl-[2-(propylsulfonylamino)propanoyl]amino]butanoic acid
CID 60825554
N-(2-hydroxyethyl)-N-prop-2-enyl-2-(propylsulfonylamino)propanamide
CID 115775972
ethyl 2-[propan-2-yl-[2-(propylsulfonylamino)propanoyl]amino]acetate
CID 61022871
(2S)-2-(propylsulfonylamino)propanoic acid
CID 7130952
2-(carbamoylamino)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide
CID 43573322
2-[carboxymethyl-[2-(propylsulfonylamino)propanoyl]amino]acetic acid
CID 63650978
N-(2-hydroxyethyl)-2-(propylsulfonylamino)propanamide
CID 43416219
3-[cyclopropyl-[2-(propylsulfonylamino)propanoyl]amino]propanoic acid
CID 60844190
methyl 4-[methyl-[2-(propylsulfonylamino)propanoyl]amino]butanoate
CID 60714617
N-(1-hydroxy-4-methylpentan-3-yl)-2-(propylsulfonylamino)propanamide
CID 103782266
2-(4-aminobutylsulfonylamino)-N-ethyl-N-methylpropanamide
CID 103108271
ethyl 2-[prop-2-enyl-[2-(propylsulfonylamino)propanoyl]amino]acetate
CID 115538843

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide?
The IUPAC name of N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide (CID 43573547) is N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide is CCCS(=O)(=O)NC(C)C(=O)N(CCO)C(C)C.
What is the InChIKey of N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide?
The InChIKey is BSBIRZUTDBHZHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O4S/c1-5-8-18(16,17)12-10(4)11(15)13(6-7-14)9(2)3/h9-10,12,14H,5-8H2,1-4H3.
What are the key properties of N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide?
N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide has a molecular weight of 280.39 g/mol, XLogP of -0.07, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-propan-2-yl-2-(propylsulfonylamino)propanamide is sourced from PubChem (CID 43573547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).