N-benzyl-N-methylmorpholine-4-carboxamide

C13H18N2O2 — CID 669645

IUPACN-benzyl-N-methylmorpholine-4-carboxamide
SMILESCN(Cc1ccccc1)C(=O)N1CCOCC1
InChIInChI=1S/C13H18N2O2/c1-14(11-12-5-3-2-4-6-12)13(16)15-7-9-17-10-8-15/h2-6H,7-11H2,1H3
InChIKeyRHGQAVNMERCVFL-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.57
Rot. Bonds2

About N-benzyl-N-methylmorpholine-4-carboxamide

N-benzyl-N-methylmorpholine-4-carboxamide (PubChem CID 669645) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-benzyl-N-methylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-methylmorpholine-4-carboxamide
PubChem CID669645
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-benzyl-N-methylmorpholine-4-carboxamide
SMILESCN(Cc1ccccc1)C(=O)N1CCOCC1
InChIInChI=1S/C13H18N2O2/c1-14(11-12-5-3-2-4-6-12)13(16)15-7-9-17-10-8-15/h2-6H,7-11H2,1H3
InChIKeyRHGQAVNMERCVFL-UHFFFAOYSA-N
XLogP1.57
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methylmorpholine-4-carboxamide?
The IUPAC name of N-benzyl-N-methylmorpholine-4-carboxamide (CID 669645) is N-benzyl-N-methylmorpholine-4-carboxamide.
What is the SMILES notation for N-benzyl-N-methylmorpholine-4-carboxamide?
The canonical SMILES for N-benzyl-N-methylmorpholine-4-carboxamide is CN(Cc1ccccc1)C(=O)N1CCOCC1.
What is the InChIKey of N-benzyl-N-methylmorpholine-4-carboxamide?
The InChIKey is RHGQAVNMERCVFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-14(11-12-5-3-2-4-6-12)13(16)15-7-9-17-10-8-15/h2-6H,7-11H2,1H3.
What are the key properties of N-benzyl-N-methylmorpholine-4-carboxamide?
N-benzyl-N-methylmorpholine-4-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 1.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methylmorpholine-4-carboxamide is sourced from PubChem (CID 669645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).