N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide

C18H21NO2 — CID 111442382

IUPACN-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide
SMILESCc1cccc(C(C)C(=O)Nc2ccc(CCO)cc2)c1
InChIInChI=1S/C18H21NO2/c1-13-4-3-5-16(12-13)14(2)18(21)19-17-8-6-15(7-9-17)10-11-20/h3-9,12,14,20H,10-11H2,1-2H3,(H,19,21)
InChIKeyMXPGWMQGYGHWLR-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.27
Rot. Bonds5

About N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide

N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide (PubChem CID 111442382) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide.

Molecular Properties

Compound NameN-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide
PubChem CID111442382
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide
SMILESCc1cccc(C(C)C(=O)Nc2ccc(CCO)cc2)c1
InChIInChI=1S/C18H21NO2/c1-13-4-3-5-16(12-13)14(2)18(21)19-17-8-6-15(7-9-17)10-11-20/h3-9,12,14,20H,10-11H2,1-2H3,(H,19,21)
InChIKeyMXPGWMQGYGHWLR-UHFFFAOYSA-N
XLogP3.27
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-aminophenyl)-N-(4-methylphenyl)propanamide
CID 106590701
N-(3-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 5183452
3-[4-[2-(3-fluorophenyl)propanoylamino]phenyl]-2-methylpropanoic acid
CID 120541256
N-[4-(2-hydroxyethyl)phenyl]-2-methyl-3-methylsulfanylpropanamide
CID 75381692
3-(ethylamino)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide
CID 62838562
(2S)-2-(3-methylphenyl)propanoate
CID 86312552
N-[4-(2-hydroxyethyl)phenyl]acetamide
CID 3295905
sodium 2-(3-methylphenyl)propanoate
CID 23706698
N,2-bis[4-(2-methylpropyl)phenyl]propanamide
CID 3436173
N-[4-[(2,5-dioxopyrrolidin-1-yl)methyl]phenyl]-2-(3-hydroxyphenyl)propanamide
CID 166256025
(2S)-2-(carbamoylamino)-N-[4-(2-hydroxyethyl)phenyl]-3-methylbutanamide
CID 51985199
N-[4-(cyanomethyl)phenyl]-2-phenylpropanamide
CID 104916745

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide?
The IUPAC name of N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide (CID 111442382) is N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide.
What is the SMILES notation for N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide?
The canonical SMILES for N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide is Cc1cccc(C(C)C(=O)Nc2ccc(CCO)cc2)c1.
What is the InChIKey of N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide?
The InChIKey is MXPGWMQGYGHWLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-13-4-3-5-16(12-13)14(2)18(21)19-17-8-6-15(7-9-17)10-11-20/h3-9,12,14,20H,10-11H2,1-2H3,(H,19,21).
What are the key properties of N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide?
N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide has a molecular weight of 283.37 g/mol, XLogP of 3.27, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-hydroxyethyl)phenyl]-2-(3-methylphenyl)propanamide is sourced from PubChem (CID 111442382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).