1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide

C6H12N4O4S — CID 151708967

IUPAC1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide
SMILESNC(=O)C1CN(C(=O)CNS(N)(=O)=O)C1
InChIInChI=1S/C6H12N4O4S/c7-6(12)4-2-10(3-4)5(11)1-9-15(8,13)14/h4,9H,1-3H2,(H2,7,12)(H2,8,13,14)
InChIKeyRGDPAMLZIDTSQG-UHFFFAOYSA-N
MW236.25 g/mol
LogP-3.28
Rot. Bonds4

About 1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide

1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide (PubChem CID 151708967) has the molecular formula C6H12N4O4S and a molecular weight of 236.25 g/mol. Its IUPAC name is 1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide.

Molecular Properties

Compound Name1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide
PubChem CID151708967
Molecular FormulaC6H12N4O4S
Molecular Weight236.25 g/mol
Exact Mass236.06
IUPAC Name1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide
SMILESNC(=O)C1CN(C(=O)CNS(N)(=O)=O)C1
InChIInChI=1S/C6H12N4O4S/c7-6(12)4-2-10(3-4)5(11)1-9-15(8,13)14/h4,9H,1-3H2,(H2,7,12)(H2,8,13,14)
InChIKeyRGDPAMLZIDTSQG-UHFFFAOYSA-N
XLogP-3.28
TPSA135.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.25
LogP ≤ 5-3.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide
CID 162460104
3-carbamoylazetidine-1-carboxylic acid
CID 22731075
1-N,1-N-dimethylazetidine-1,3-dicarboxamide
CID 130950203
1-(propan-2-ylamino)azetidine-3-carboxamide
CID 142973194
1-(2-hydrazinyl-2-oxoacetyl)azetidine-3-carboxamide
CID 131114882
1-N-cyclopropylazetidine-1,3-dicarboxamide
CID 131048719
1-[1-[2-[(3-chloro-4-fluorophenyl)sulfonylamino]acetyl]azetidin-3-yl]piperidine-4-carboxamide
CID 121153899
[2-(3-fluoroazetidin-1-yl)-2-oxoethyl]urea
CID 126989063
(6S)-1-acetyl-4-[2-(methanesulfonamido)acetyl]-N-methyl-1,4-diazepane-6-carboxamide
CID 124981885
N-[2-[(3R,4S)-3-cyclopropyl-4-(dimethylamino)pyrrolidin-1-yl]-2-oxoethyl]methanesulfonamide
CID 133111572
1-(2-methoxyacetyl)-4-methylsulfonyl-1,4-diazepane-6-carboxamide
CID 127245306
2-amino-N-[2-oxo-2-[3-[(sulfamoylamino)methyl]piperidin-1-yl]ethyl]acetamide
CID 60963858

Frequently Asked Questions

What is the IUPAC name of 1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide?
The IUPAC name of 1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide (CID 151708967) is 1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide.
What is the SMILES notation for 1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide?
The canonical SMILES for 1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide is NC(=O)C1CN(C(=O)CNS(N)(=O)=O)C1.
What is the InChIKey of 1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide?
The InChIKey is RGDPAMLZIDTSQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4O4S/c7-6(12)4-2-10(3-4)5(11)1-9-15(8,13)14/h4,9H,1-3H2,(H2,7,12)(H2,8,13,14).
What are the key properties of 1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide?
1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide has a molecular weight of 236.25 g/mol, XLogP of -3.28, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(sulfamoylamino)acetyl]azetidine-3-carboxamide is sourced from PubChem (CID 151708967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).