2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide

C19H28N2O4 — CID 136538659

IUPAC2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide
SMILESCOc1ccccc1OC(C)CNC(=O)N1CC(C)OC(C2CC2)C1
InChIInChI=1S/C19H28N2O4/c1-13(24-17-7-5-4-6-16(17)23-3)10-20-19(22)21-11-14(2)25-18(12-21)15-8-9-15/h4-7,13-15,18H,8-12H2,1-3H3,(H,20,22)
InChIKeyLNCSNNZIKIIQAL-UHFFFAOYSA-N
MW348.44 g/mol
LogP2.67
Rot. Bonds6

About 2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide

2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide (PubChem CID 136538659) has the molecular formula C19H28N2O4 and a molecular weight of 348.44 g/mol. Its IUPAC name is 2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide
PubChem CID136538659
Molecular FormulaC19H28N2O4
Molecular Weight348.44 g/mol
Exact Mass348.20
IUPAC Name2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide
SMILESCOc1ccccc1OC(C)CNC(=O)N1CC(C)OC(C2CC2)C1
InChIInChI=1S/C19H28N2O4/c1-13(24-17-7-5-4-6-16(17)23-3)10-20-19(22)21-11-14(2)25-18(12-21)15-8-9-15/h4-7,13-15,18H,8-12H2,1-3H3,(H,20,22)
InChIKeyLNCSNNZIKIIQAL-UHFFFAOYSA-N
XLogP2.67
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.44
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide?
The IUPAC name of 2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide (CID 136538659) is 2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide is COc1ccccc1OC(C)CNC(=O)N1CC(C)OC(C2CC2)C1.
What is the InChIKey of 2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide?
The InChIKey is LNCSNNZIKIIQAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O4/c1-13(24-17-7-5-4-6-16(17)23-3)10-20-19(22)21-11-14(2)25-18(12-21)15-8-9-15/h4-7,13-15,18H,8-12H2,1-3H3,(H,20,22).
What are the key properties of 2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide?
2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide has a molecular weight of 348.44 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[2-(2-methoxyphenoxy)propyl]-6-methylmorpholine-4-carboxamide is sourced from PubChem (CID 136538659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).