N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide

C19H24N2O2 — CID 119439844

IUPACN-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide
SMILESCCNCc1ccccc1NC(=O)CCOc1cccc(C)c1
InChIInChI=1S/C19H24N2O2/c1-3-20-14-16-8-4-5-10-18(16)21-19(22)11-12-23-17-9-6-7-15(2)13-17/h4-10,13,20H,3,11-12,14H2,1-2H3,(H,21,22)
InChIKeyHLCZDNSUGJNHIP-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.51
Rot. Bonds8

About N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide

N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide (PubChem CID 119439844) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide.

Molecular Properties

Compound NameN-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide
PubChem CID119439844
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide
SMILESCCNCc1ccccc1NC(=O)CCOc1cccc(C)c1
InChIInChI=1S/C19H24N2O2/c1-3-20-14-16-8-4-5-10-18(16)21-19(22)11-12-23-17-9-6-7-15(2)13-17/h4-10,13,20H,3,11-12,14H2,1-2H3,(H,21,22)
InChIKeyHLCZDNSUGJNHIP-UHFFFAOYSA-N
XLogP3.51
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(bromomethyl)phenyl]-3-(3-methylphenoxy)propanamide
CID 114309727
N-(2-ethoxyphenyl)-3-(3-methylphenoxy)propanamide
CID 2939056
N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide
CID 9413689
N-(2-ethylphenyl)-2-[methyl-[2-(3-methylphenoxy)ethyl]amino]acetamide
CID 27121748
N-[2-(ethylaminomethyl)phenyl]-3-(2-methoxyphenoxy)propanamide
CID 119439282
N-ethyl-3-(3-methylphenoxy)propanamide
CID 2129235
2-[2-[3-(3,5-dimethylphenoxy)propanoylamino]phenyl]acetic acid
CID 119218262
3-(2,4-dimethylphenyl)-N-[2-(ethylaminomethyl)phenyl]propanamide;hydrochloride
CID 119439013
N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide
CID 808300
3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide
CID 39992819
N-(2-bromo-5-methylphenyl)-3-(3-methylphenoxy)propanamide
CID 82712318
N-(2-bromo-4-methylphenyl)-3-(3-methylphenoxy)propanamide
CID 17395169

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide?
The IUPAC name of N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide (CID 119439844) is N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide.
What is the SMILES notation for N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide?
The canonical SMILES for N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide is CCNCc1ccccc1NC(=O)CCOc1cccc(C)c1.
What is the InChIKey of N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide?
The InChIKey is HLCZDNSUGJNHIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-3-20-14-16-8-4-5-10-18(16)21-19(22)11-12-23-17-9-6-7-15(2)13-17/h4-10,13,20H,3,11-12,14H2,1-2H3,(H,21,22).
What are the key properties of N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide?
N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide has a molecular weight of 312.41 g/mol, XLogP of 3.51, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide is sourced from PubChem (CID 119439844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).