N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide

C20H30N2O4 — CID 90607349

IUPACN-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)N(CCN1CCOCC1)C1CCOCC1
InChIInChI=1S/C20H30N2O4/c1-17(26-19-5-3-2-4-6-19)20(23)22(18-7-13-24-14-8-18)10-9-21-11-15-25-16-12-21/h2-6,17-18H,7-16H2,1H3
InChIKeySCLMSFZBJJNATI-UHFFFAOYSA-N
MW362.47 g/mol
LogP1.79
Rot. Bonds7

About N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide

N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide (PubChem CID 90607349) has the molecular formula C20H30N2O4 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide
PubChem CID90607349
Molecular FormulaC20H30N2O4
Molecular Weight362.47 g/mol
Exact Mass362.22
IUPAC NameN-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)N(CCN1CCOCC1)C1CCOCC1
InChIInChI=1S/C20H30N2O4/c1-17(26-19-5-3-2-4-6-19)20(23)22(18-7-13-24-14-8-18)10-9-21-11-15-25-16-12-21/h2-6,17-18H,7-16H2,1H3
InChIKeySCLMSFZBJJNATI-UHFFFAOYSA-N
XLogP1.79
TPSA51.24 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide (CID 90607349) is N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide is CC(Oc1ccccc1)C(=O)N(CCN1CCOCC1)C1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide?
The InChIKey is SCLMSFZBJJNATI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O4/c1-17(26-19-5-3-2-4-6-19)20(23)22(18-7-13-24-14-8-18)10-9-21-11-15-25-16-12-21/h2-6,17-18H,7-16H2,1H3.
What are the key properties of N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide?
N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide has a molecular weight of 362.47 g/mol, XLogP of 1.79, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenoxypropanamide is sourced from PubChem (CID 90607349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).