N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide

C19H24N2O3 — CID 119439770

IUPACN-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide
SMILESCCNCc1ccccc1NC(=O)c1ccc(OCCOC)cc1
InChIInChI=1S/C19H24N2O3/c1-3-20-14-16-6-4-5-7-18(16)21-19(22)15-8-10-17(11-9-15)24-13-12-23-2/h4-11,20H,3,12-14H2,1-2H3,(H,21,22)
InChIKeyRNLKFDWPPJOZFQ-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.07
Rot. Bonds9

About N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide

N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide (PubChem CID 119439770) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide.

Molecular Properties

Compound NameN-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide
PubChem CID119439770
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC NameN-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide
SMILESCCNCc1ccccc1NC(=O)c1ccc(OCCOC)cc1
InChIInChI=1S/C19H24N2O3/c1-3-20-14-16-6-4-5-7-18(16)21-19(22)15-8-10-17(11-9-15)24-13-12-23-2/h4-11,20H,3,12-14H2,1-2H3,(H,21,22)
InChIKeyRNLKFDWPPJOZFQ-UHFFFAOYSA-N
XLogP3.07
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(cyclopropylmethoxy)-N-[2-(ethylaminomethyl)phenyl]benzamide
CID 119439579
4-acetyl-N-[2-(ethylaminomethyl)phenyl]benzamide;hydrochloride
CID 86779920
N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide
CID 119438730
N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethylsulfamoyl)benzamide;hydrochloride
CID 119439653
N-[2-(ethylaminomethyl)phenyl]-4-methylsulfanylbenzamide
CID 79213773
4-[4-[(2-ethylphenyl)carbamoyl]phenoxy]butanoic acid
CID 22680833
3,4-diethoxy-N-[2-(ethylaminomethyl)phenyl]benzamide
CID 119438964
2-[[4-(2-methoxyethoxy)benzoyl]amino]benzamide
CID 15943277
N-[2-[(4-butoxybenzoyl)amino]phenyl]-4-methoxybenzamide
CID 10811951
1-N-(2,2-dimethylpropyl)-4-N-[2-(ethylaminomethyl)phenyl]benzene-1,4-dicarboxamide
CID 119440330
4-(2-methoxyethoxy)-N-phenylbenzamide
CID 15943269
N-[2-(ethylaminomethyl)phenyl]-3,5-dimethylbenzamide
CID 43601336

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide?
The IUPAC name of N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide (CID 119439770) is N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide.
What is the SMILES notation for N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide?
The canonical SMILES for N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide is CCNCc1ccccc1NC(=O)c1ccc(OCCOC)cc1.
What is the InChIKey of N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide?
The InChIKey is RNLKFDWPPJOZFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-3-20-14-16-6-4-5-7-18(16)21-19(22)15-8-10-17(11-9-15)24-13-12-23-2/h4-11,20H,3,12-14H2,1-2H3,(H,21,22).
What are the key properties of N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide?
N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide has a molecular weight of 328.41 g/mol, XLogP of 3.07, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide is sourced from PubChem (CID 119439770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).