N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide

C8H17N3O4S — CID 112573894

IUPACN-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide
SMILESCC(C)NC(=O)C1COCCN1S(N)(=O)=O
InChIInChI=1S/C8H17N3O4S/c1-6(2)10-8(12)7-5-15-4-3-11(7)16(9,13)14/h6-7H,3-5H2,1-2H3,(H,10,12)(H2,9,13,14)
InChIKeyYGHHWRJTNKJJFW-UHFFFAOYSA-N
MW251.31 g/mol
LogP-1.58
Rot. Bonds3

About N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide

N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide (PubChem CID 112573894) has the molecular formula C8H17N3O4S and a molecular weight of 251.31 g/mol. Its IUPAC name is N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide
PubChem CID112573894
Molecular FormulaC8H17N3O4S
Molecular Weight251.31 g/mol
Exact Mass251.09
IUPAC NameN-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide
SMILESCC(C)NC(=O)C1COCCN1S(N)(=O)=O
InChIInChI=1S/C8H17N3O4S/c1-6(2)10-8(12)7-5-15-4-3-11(7)16(9,13)14/h6-7H,3-5H2,1-2H3,(H,10,12)(H2,9,13,14)
InChIKeyYGHHWRJTNKJJFW-UHFFFAOYSA-N
XLogP-1.58
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 5-1.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-N-propan-2-ylmorpholine-3,4-dicarboxamide
CID 83106391
(3S)-N,4-di(propan-2-yl)morpholine-3-carboxamide
CID 140959044
N,4-di(propan-2-yl)morpholine-3-carboxamide
CID 118118161
N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide
CID 170311116
4-(4-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83106165
4-(5-hydrazinyl-5-oxopentan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83105965
4-(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83105075
4-(1-aminobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83106097
4-(2,3-diamino-3-oxopropyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83103304
ethyl 2-[3-(propan-2-ylcarbamoyl)morpholin-4-yl]acetate
CID 83103448
4-[[2-(aminomethyl)phenyl]methyl]-N-propan-2-ylmorpholine-3-carboxamide
CID 83098587
4-(3-amino-3-hydroxyimino-2-methylpropanoyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83103841

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide?
The IUPAC name of N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide (CID 112573894) is N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide.
What is the SMILES notation for N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide?
The canonical SMILES for N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide is CC(C)NC(=O)C1COCCN1S(N)(=O)=O.
What is the InChIKey of N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide?
The InChIKey is YGHHWRJTNKJJFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O4S/c1-6(2)10-8(12)7-5-15-4-3-11(7)16(9,13)14/h6-7H,3-5H2,1-2H3,(H,10,12)(H2,9,13,14).
What are the key properties of N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide?
N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide has a molecular weight of 251.31 g/mol, XLogP of -1.58, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-4-sulfamoylmorpholine-3-carboxamide is sourced from PubChem (CID 112573894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).