1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one

C8H13N5O2S — CID 102630515

IUPAC1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one
SMILESNCc1nnc(SCCN2CCNC2=O)o1
InChIInChI=1S/C8H13N5O2S/c9-5-6-11-12-8(15-6)16-4-3-13-2-1-10-7(13)14/h1-5,9H2,(H,10,14)
InChIKeyJXANJSXANKHFBC-UHFFFAOYSA-N
MW243.29 g/mol
LogP-0.35
Rot. Bonds5

About 1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one

1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one (PubChem CID 102630515) has the molecular formula C8H13N5O2S and a molecular weight of 243.29 g/mol. Its IUPAC name is 1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one
PubChem CID102630515
Molecular FormulaC8H13N5O2S
Molecular Weight243.29 g/mol
Exact Mass243.08
IUPAC Name1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one
SMILESNCc1nnc(SCCN2CCNC2=O)o1
InChIInChI=1S/C8H13N5O2S/c9-5-6-11-12-8(15-6)16-4-3-13-2-1-10-7(13)14/h1-5,9H2,(H,10,14)
InChIKeyJXANJSXANKHFBC-UHFFFAOYSA-N
XLogP-0.35
TPSA97.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.29
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one with MolForge

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Related Compounds

1-[2-[(5-amino-1,3-benzoxazol-2-yl)sulfanyl]ethyl]imidazolidin-2-one
CID 61359248
1-(2-fluoroethyl)imidazolidin-2-one
CID 87326772
[5-(2-methoxyethylsulfanyl)-1,3,4-oxadiazol-2-yl]methanamine
CID 102630421
[5-[2-(oxolan-2-yl)ethylsulfanyl]-1,3,4-oxadiazol-2-yl]methanamine
CID 102630087
1-[2-(2-amino-5-chlorophenyl)sulfanylethyl]imidazolidin-2-one
CID 79528744
N-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]acetamide
CID 102630633
1-(2-prop-2-ynylsulfanylethyl)imidazolidin-2-one
CID 106433189
6-[2-(2-oxoimidazolidin-1-yl)ethylsulfanyl]pyridine-3-carboxylic acid
CID 61299148
[5-(4-phenylbutylsulfanyl)-1,3,4-oxadiazol-2-yl]methanamine
CID 102630594
1-[2-(3-amino-1,2,4-triazol-1-yl)ethyl]imidazolidin-2-one
CID 60910685
[5-(2-methylprop-2-enylsulfanyl)-1,3,4-oxadiazol-2-yl]methanamine
CID 102630364
1-[2-(4-amino-2-methoxyphenyl)sulfanylethyl]imidazolidin-2-one
CID 79830082

Frequently Asked Questions

What is the IUPAC name of 1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one (CID 102630515) is 1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one is NCc1nnc(SCCN2CCNC2=O)o1.
What is the InChIKey of 1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one?
The InChIKey is JXANJSXANKHFBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O2S/c9-5-6-11-12-8(15-6)16-4-3-13-2-1-10-7(13)14/h1-5,9H2,(H,10,14).
What are the key properties of 1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one?
1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one has a molecular weight of 243.29 g/mol, XLogP of -0.35, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]imidazolidin-2-one is sourced from PubChem (CID 102630515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).