2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide

C20H23ClN2O3 — CID 53282971

IUPAC2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide
SMILESCC(Oc1ccccc1Cl)C(=O)NCc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C20H23ClN2O3/c1-15(26-19-5-3-2-4-18(19)21)20(24)22-14-16-6-8-17(9-7-16)23-10-12-25-13-11-23/h2-9,15H,10-14H2,1H3,(H,22,24)
InChIKeyYSJIOZSWNYEZMN-UHFFFAOYSA-N
MW374.87 g/mol
LogP3.26
Rot. Bonds6

About 2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide

2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide (PubChem CID 53282971) has the molecular formula C20H23ClN2O3 and a molecular weight of 374.87 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide
PubChem CID53282971
Molecular FormulaC20H23ClN2O3
Molecular Weight374.87 g/mol
Exact Mass374.14
IUPAC Name2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide
SMILESCC(Oc1ccccc1Cl)C(=O)NCc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C20H23ClN2O3/c1-15(26-19-5-3-2-4-18(19)21)20(24)22-14-16-6-8-17(9-7-16)23-10-12-25-13-11-23/h2-9,15H,10-14H2,1H3,(H,22,24)
InChIKeyYSJIOZSWNYEZMN-UHFFFAOYSA-N
XLogP3.26
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.87
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-(2-chlorophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]propanamide
CID 39643721
2-(2-chlorophenoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 46581557
2-(2-chlorophenoxy)-N-[[4-(4-prop-2-enoylpiperazin-1-yl)phenyl]methyl]propanamide
CID 172887268
(2S)-2-(2-chlorophenoxy)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide
CID 94015153
N-[(4-morpholin-4-ylphenyl)methyl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propanamide
CID 133235388
N-[(4-morpholin-4-ylphenyl)methyl]-2-naphthalen-2-yloxypropanamide
CID 53282855
(2S)-2-(2-chlorophenoxy)-N-[(4-fluorophenyl)methyl]propanamide
CID 26529894
2-(2,5-dimethylphenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide
CID 53282901
N-[(4-piperidin-1-ylphenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide
CID 43908232
(2S)-2-(2-chlorophenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]propanamide
CID 28635676
2-(4-bromophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide
CID 132666019
2-(2-chlorophenoxy)-N-[[4-(dimethylamino)phenyl]methyl]propanamide
CID 53282907

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide (CID 53282971) is 2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide is CC(Oc1ccccc1Cl)C(=O)NCc1ccc(N2CCOCC2)cc1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide?
The InChIKey is YSJIOZSWNYEZMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O3/c1-15(26-19-5-3-2-4-18(19)21)20(24)22-14-16-6-8-17(9-7-16)23-10-12-25-13-11-23/h2-9,15H,10-14H2,1H3,(H,22,24).
What are the key properties of 2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide?
2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide has a molecular weight of 374.87 g/mol, XLogP of 3.26, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide is sourced from PubChem (CID 53282971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).