(3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone

C10H18N2O2 — CID 61156609

IUPAC(3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone
SMILESCC1COCCN1C(=O)[C@@H]1CCCN1
InChIInChI=1S/C10H18N2O2/c1-8-7-14-6-5-12(8)10(13)9-3-2-4-11-9/h8-9,11H,2-7H2,1H3/t8?,9-/m0/s1
InChIKeyCWGRWDRNFNGRJO-GKAPJAKFSA-N
MW198.27 g/mol
LogP-0.01
Rot. Bonds1

About (3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone

(3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone (PubChem CID 61156609) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is (3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone.

Molecular Properties

Compound Name(3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone
PubChem CID61156609
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name(3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone
SMILESCC1COCCN1C(=O)[C@@H]1CCCN1
InChIInChI=1S/C10H18N2O2/c1-8-7-14-6-5-12(8)10(13)9-3-2-4-11-9/h8-9,11H,2-7H2,1H3/t8?,9-/m0/s1
InChIKeyCWGRWDRNFNGRJO-GKAPJAKFSA-N
XLogP-0.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone?
The IUPAC name of (3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone (CID 61156609) is (3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone.
What is the SMILES notation for (3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone?
The canonical SMILES for (3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone is CC1COCCN1C(=O)[C@@H]1CCCN1.
What is the InChIKey of (3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone?
The InChIKey is CWGRWDRNFNGRJO-GKAPJAKFSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-8-7-14-6-5-12(8)10(13)9-3-2-4-11-9/h8-9,11H,2-7H2,1H3/t8?,9-/m0/s1.
What are the key properties of (3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone?
(3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone has a molecular weight of 198.27 g/mol, XLogP of -0.01, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylmorpholin-4-yl)-[(2S)-pyrrolidin-2-yl]methanone is sourced from PubChem (CID 61156609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).