2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide

C23H23ClN2O3 — CID 143188428

IUPAC2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide
SMILESNC(CO)C(=O)Nc1ccc(OCCc2ccc(-c3ccc(Cl)cc3)cc2)cc1
InChIInChI=1S/C23H23ClN2O3/c24-19-7-5-18(6-8-19)17-3-1-16(2-4-17)13-14-29-21-11-9-20(10-12-21)26-23(28)22(25)15-27/h1-12,22,27H,13-15,25H2,(H,26,28)
InChIKeyDYJBZLSCAIMWGN-UHFFFAOYSA-N
MW410.90 g/mol
LogP3.89
Rot. Bonds8

About 2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide

2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide (PubChem CID 143188428) has the molecular formula C23H23ClN2O3 and a molecular weight of 410.90 g/mol. Its IUPAC name is 2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide.

Molecular Properties

Compound Name2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide
PubChem CID143188428
Molecular FormulaC23H23ClN2O3
Molecular Weight410.90 g/mol
Exact Mass410.14
IUPAC Name2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide
SMILESNC(CO)C(=O)Nc1ccc(OCCc2ccc(-c3ccc(Cl)cc3)cc2)cc1
InChIInChI=1S/C23H23ClN2O3/c24-19-7-5-18(6-8-19)17-3-1-16(2-4-17)13-14-29-21-11-9-20(10-12-21)26-23(28)22(25)15-27/h1-12,22,27H,13-15,25H2,(H,26,28)
InChIKeyDYJBZLSCAIMWGN-UHFFFAOYSA-N
XLogP3.89
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.90
LogP ≤ 53.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-[4-(4-chlorophenoxy)phenyl]-4-phenylbutanamide
CID 67010614
(2S)-2-amino-N-[4-[(4-chlorophenyl)methoxy]phenyl]propanamide
CID 22690589
3-[4-[2-(4-chlorophenyl)ethoxy]phenyl]-1-methoxy-1-methylurea
CID 12953558
[(2S)-2-amino-3-oxo-3-[4-[3-(4-phenylphenyl)propoxy]anilino]propyl] dihydrogen phosphate
CID 143188439
2-[4-[2-(4-chlorophenoxy)ethyl]phenyl]acetamide
CID 72937831
N-[4-[2-(4-methylphenyl)ethoxy]phenyl]acetamide
CID 13017655
(2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide
CID 163928568
N-[4-[2-[4-(2-cyanophenyl)phenyl]ethoxy]phenyl]-3-hydroxy-2-methylpropanamide
CID 143188435
2-(4-chlorophenoxy)-N-[4-(3-phenylpropoxy)phenyl]propanamide
CID 17130174
2-(4-chlorophenyl)-N-[4-(3-phenylpropoxy)phenyl]acetamide
CID 17130169
2-amino-2-methyl-N-[4-[2-(4-pyridin-4-ylphenyl)ethoxy]phenyl]propanamide
CID 91060090
2-amino-N-(4-chlorophenyl)butanediamide
CID 60846546

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide?
The IUPAC name of 2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide (CID 143188428) is 2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide.
What is the SMILES notation for 2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide?
The canonical SMILES for 2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide is NC(CO)C(=O)Nc1ccc(OCCc2ccc(-c3ccc(Cl)cc3)cc2)cc1.
What is the InChIKey of 2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide?
The InChIKey is DYJBZLSCAIMWGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23ClN2O3/c24-19-7-5-18(6-8-19)17-3-1-16(2-4-17)13-14-29-21-11-9-20(10-12-21)26-23(28)22(25)15-27/h1-12,22,27H,13-15,25H2,(H,26,28).
What are the key properties of 2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide?
2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide has a molecular weight of 410.90 g/mol, XLogP of 3.89, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-[2-[4-(4-chlorophenyl)phenyl]ethoxy]phenyl]-3-hydroxypropanamide is sourced from PubChem (CID 143188428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).