1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one

C11H20N4O3S2 — CID 21418013

IUPAC1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one
SMILESO=C1N(SN2CCOCC2)CCN1SN1CCOCC1
InChIInChI=1S/C11H20N4O3S2/c16-11-14(19-12-3-7-17-8-4-12)1-2-15(11)20-13-5-9-18-10-6-13/h1-10H2
InChIKeyILFJDNLFXJECHG-UHFFFAOYSA-N
MW320.44 g/mol
LogP0.51
Rot. Bonds4

About 1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one

1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one (PubChem CID 21418013) has the molecular formula C11H20N4O3S2 and a molecular weight of 320.44 g/mol. Its IUPAC name is 1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one.

Molecular Properties

Compound Name1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one
PubChem CID21418013
Molecular FormulaC11H20N4O3S2
Molecular Weight320.44 g/mol
Exact Mass320.10
IUPAC Name1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one
SMILESO=C1N(SN2CCOCC2)CCN1SN1CCOCC1
InChIInChI=1S/C11H20N4O3S2/c16-11-14(19-12-3-7-17-8-4-12)1-2-15(11)20-13-5-9-18-10-6-13/h1-10H2
InChIKeyILFJDNLFXJECHG-UHFFFAOYSA-N
XLogP0.51
TPSA48.49 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 50.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulphur_nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-carboxamide
CID 2147557
N,N-diethyl-4-(morpholine-4-carbonyl)piperazine-1-carboxamide
CID 1094968
1,3-Bis(morpholin-4-ylmethyl)imidazolidin-2-one
CID 1218114
4-{[4-(1-Pyrrolidinylsulfonyl)-1-piperazinyl]carbonyl}morpholine
CID 16958283
4-Methyl-1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one
CID 21418026
1,3-Bis[(2,6-dimethylmorpholin-4-yl)sulfanyl]imidazolidin-2-one
CID 21418030
1,3-Bis[(morpholin-4-yl)sulfanyl]imidazolidine-2,4-dione
CID 71372374
[4-[2-(Dimethylamino)ethyl]piperazin-1-yl]-morpholin-4-ylmethanone
CID 115777127

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one?
The IUPAC name of 1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one (CID 21418013) is 1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one.
What is the SMILES notation for 1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one?
The canonical SMILES for 1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one is O=C1N(SN2CCOCC2)CCN1SN1CCOCC1.
What is the InChIKey of 1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one?
The InChIKey is ILFJDNLFXJECHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O3S2/c16-11-14(19-12-3-7-17-8-4-12)1-2-15(11)20-13-5-9-18-10-6-13/h1-10H2.
What are the key properties of 1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one?
1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one has a molecular weight of 320.44 g/mol, XLogP of 0.51, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(morpholin-4-ylsulfanyl)imidazolidin-2-one is sourced from PubChem (CID 21418013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).