4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide

C11H21N3O2 — CID 140671747

IUPAC4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide
SMILESCN1CCC[C@@H](N2CCOC(C(N)=O)C2)C1
InChIInChI=1S/C11H21N3O2/c1-13-4-2-3-9(7-13)14-5-6-16-10(8-14)11(12)15/h9-10H,2-8H2,1H3,(H2,12,15)/t9-,10?/m1/s1
InChIKeyOCRKZESNJQPNLH-YHMJZVADSA-N
MW227.31 g/mol
LogP-0.73
Rot. Bonds2

About 4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide

4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide (PubChem CID 140671747) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide.

Molecular Properties

Compound Name4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide
PubChem CID140671747
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide
SMILESCN1CCC[C@@H](N2CCOC(C(N)=O)C2)C1
InChIInChI=1S/C11H21N3O2/c1-13-4-2-3-9(7-13)14-5-6-16-10(8-14)11(12)15/h9-10H,2-8H2,1H3,(H2,12,15)/t9-,10?/m1/s1
InChIKeyOCRKZESNJQPNLH-YHMJZVADSA-N
XLogP-0.73
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide?
The IUPAC name of 4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide (CID 140671747) is 4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide.
What is the SMILES notation for 4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide?
The canonical SMILES for 4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide is CN1CCC[C@@H](N2CCOC(C(N)=O)C2)C1.
What is the InChIKey of 4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide?
The InChIKey is OCRKZESNJQPNLH-YHMJZVADSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-13-4-2-3-9(7-13)14-5-6-16-10(8-14)11(12)15/h9-10H,2-8H2,1H3,(H2,12,15)/t9-,10?/m1/s1.
What are the key properties of 4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide?
4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide has a molecular weight of 227.31 g/mol, XLogP of -0.73, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-1-methylpiperidin-3-yl]morpholine-2-carboxamide is sourced from PubChem (CID 140671747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).