1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one

C9H15N3O2 — CID 80580840

IUPAC1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one
SMILESCn1ccn(CC2CNCCO2)c1=O
InChIInChI=1S/C9H15N3O2/c1-11-3-4-12(9(11)13)7-8-6-10-2-5-14-8/h3-4,8,10H,2,5-7H2,1H3
InChIKeyZASQYYXUKLJPIA-UHFFFAOYSA-N
MW197.24 g/mol
LogP-0.82
Rot. Bonds2

About 1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one

1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one (PubChem CID 80580840) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one.

Molecular Properties

Compound Name1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one
PubChem CID80580840
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one
SMILESCn1ccn(CC2CNCCO2)c1=O
InChIInChI=1S/C9H15N3O2/c1-11-3-4-12(9(11)13)7-8-6-10-2-5-14-8/h3-4,8,10H,2,5-7H2,1H3
InChIKeyZASQYYXUKLJPIA-UHFFFAOYSA-N
XLogP-0.82
TPSA48.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-0.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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2-[(3-methylazetidin-1-yl)methyl]morpholine
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4-(morpholin-2-ylmethyl)thiomorpholine-3,5-dione
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4-tert-butyl-1-(morpholin-2-ylmethyl)imidazolidin-2-one
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4-(1-methylpyrrolidin-3-yl)-1-(morpholin-2-ylmethyl)imidazolidin-2-one
CID 116980702
2-(morpholin-2-ylmethyl)morpholine
CID 18506039
2-[(4-methylpiperazin-1-yl)methyl]morpholine
CID 14627568
3-(morpholin-2-ylmethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 64532844
1-methyl-3-[methyl-[[(2S)-morpholin-2-yl]methyl]amino]pyrazin-2-one
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4-(2-morpholin-2-ylethyl)-1H-1,2,4-triazol-5-one
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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one?
The IUPAC name of 1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one (CID 80580840) is 1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one.
What is the SMILES notation for 1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one?
The canonical SMILES for 1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one is Cn1ccn(CC2CNCCO2)c1=O.
What is the InChIKey of 1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one?
The InChIKey is ZASQYYXUKLJPIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-11-3-4-12(9(11)13)7-8-6-10-2-5-14-8/h3-4,8,10H,2,5-7H2,1H3.
What are the key properties of 1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one?
1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one has a molecular weight of 197.24 g/mol, XLogP of -0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(morpholin-2-ylmethyl)imidazol-2-one is sourced from PubChem (CID 80580840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).