3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide

C21H26N2O3 — CID 110637305

IUPAC3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide
SMILESCOc1cccc(CCC(=O)Nc2ccc(N3CCOC(C)C3)cc2)c1
InChIInChI=1S/C21H26N2O3/c1-16-15-23(12-13-26-16)19-9-7-18(8-10-19)22-21(24)11-6-17-4-3-5-20(14-17)25-2/h3-5,7-10,14,16H,6,11-13,15H2,1-2H3,(H,22,24)
InChIKeyPWZPNYZNLRVJES-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.49
Rot. Bonds6

About 3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide

3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide (PubChem CID 110637305) has the molecular formula C21H26N2O3 and a molecular weight of 354.45 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide.

Molecular Properties

Compound Name3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide
PubChem CID110637305
Molecular FormulaC21H26N2O3
Molecular Weight354.45 g/mol
Exact Mass354.19
IUPAC Name3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide
SMILESCOc1cccc(CCC(=O)Nc2ccc(N3CCOC(C)C3)cc2)c1
InChIInChI=1S/C21H26N2O3/c1-16-15-23(12-13-26-16)19-9-7-18(8-10-19)22-21(24)11-6-17-4-3-5-20(14-17)25-2/h3-5,7-10,14,16H,6,11-13,15H2,1-2H3,(H,22,24)
InChIKeyPWZPNYZNLRVJES-UHFFFAOYSA-N
XLogP3.49
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

3-(4-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide
CID 110637300
N-[4-(1,3-dioxolan-2-yl)phenyl]-3-(3-methoxyphenyl)propanamide
CID 110732832
N-[4-(2-methylmorpholin-4-yl)phenyl]-2-phenylacetamide
CID 110637265
2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 2404248
3-(3-methoxyphenyl)-N-(3-pyrrolidin-1-ylphenyl)propanamide
CID 110361627
3-(3,5-dimethoxyphenyl)-N-(4-piperidin-1-ylphenyl)propanamide
CID 26689927
N-[3-(4-acetylpiperazin-1-yl)phenyl]-3-(3-methoxyphenyl)propanamide
CID 110368212
3-(3-methoxyphenyl)-N-[4-(1,2,4-triazol-1-yl)phenyl]propanamide
CID 37120763
3-(3-methoxyphenyl)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide
CID 110725062
N-[4-(2,5-dimethylmorpholin-4-yl)phenyl]-3-(4-methoxyphenyl)propanamide
CID 110637763
N-[4-(4-methoxypiperidin-1-yl)phenyl]-3-(3-methylphenyl)propanamide
CID 90595766
2,2-dimethyl-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide
CID 110637241

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide?
The IUPAC name of 3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide (CID 110637305) is 3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide.
What is the SMILES notation for 3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide?
The canonical SMILES for 3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide is COc1cccc(CCC(=O)Nc2ccc(N3CCOC(C)C3)cc2)c1.
What is the InChIKey of 3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide?
The InChIKey is PWZPNYZNLRVJES-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O3/c1-16-15-23(12-13-26-16)19-9-7-18(8-10-19)22-21(24)11-6-17-4-3-5-20(14-17)25-2/h3-5,7-10,14,16H,6,11-13,15H2,1-2H3,(H,22,24).
What are the key properties of 3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide?
3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide has a molecular weight of 354.45 g/mol, XLogP of 3.49, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide is sourced from PubChem (CID 110637305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).