N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide

C18H22N2O3 — CID 119438730

IUPACN-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide
SMILESCCNCc1ccccc1NC(=O)c1cc(OC)cc(OC)c1
InChIInChI=1S/C18H22N2O3/c1-4-19-12-13-7-5-6-8-17(13)20-18(21)14-9-15(22-2)11-16(10-14)23-3/h5-11,19H,4,12H2,1-3H3,(H,20,21)
InChIKeyRIIOZHXJMGHFNS-UHFFFAOYSA-N
MW314.39 g/mol
LogP3.07
Rot. Bonds7

About N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide

N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide (PubChem CID 119438730) has the molecular formula C18H22N2O3 and a molecular weight of 314.39 g/mol. Its IUPAC name is N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide
PubChem CID119438730
Molecular FormulaC18H22N2O3
Molecular Weight314.39 g/mol
Exact Mass314.16
IUPAC NameN-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide
SMILESCCNCc1ccccc1NC(=O)c1cc(OC)cc(OC)c1
InChIInChI=1S/C18H22N2O3/c1-4-19-12-13-7-5-6-8-17(13)20-18(21)14-9-15(22-2)11-16(10-14)23-3/h5-11,19H,4,12H2,1-3H3,(H,20,21)
InChIKeyRIIOZHXJMGHFNS-UHFFFAOYSA-N
XLogP3.07
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(chloromethyl)phenyl]-3,5-dimethoxybenzamide
CID 114298485
N-[2-(ethylaminomethyl)phenyl]-3,5-dimethylbenzamide
CID 43601336
3,5-dichloro-N-[2-(ethylaminomethyl)phenyl]benzamide
CID 43601335
N-[2-(ethylaminomethyl)phenyl]-4-(2-methoxyethoxy)benzamide
CID 119439770
N-[2-(ethylaminomethyl)phenyl]-3,4-dimethoxy-5-prop-2-enylbenzamide
CID 119440133
3,4-diethoxy-N-[2-(ethylaminomethyl)phenyl]benzamide
CID 119438964
4-acetyl-N-[2-(ethylaminomethyl)phenyl]benzamide;hydrochloride
CID 86779920
N-[2-(ethylaminomethyl)phenyl]-3-(2-methylpropoxy)benzamide;hydrochloride
CID 119439604
N-[2-(ethylaminomethyl)phenyl]-3,4-dimethylbenzamide;hydrochloride
CID 119440699
N-(2-chlorophenyl)-3,5-dimethoxybenzamide
CID 835443
N-[2-(ethylaminomethyl)phenyl]-2-methoxypyridine-3-carboxamide
CID 62873976
N-[2-(ethylaminomethyl)phenyl]-3-methoxy-4-prop-2-enoxybenzamide
CID 119440436

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide?
The IUPAC name of N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide (CID 119438730) is N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide.
What is the SMILES notation for N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide?
The canonical SMILES for N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide is CCNCc1ccccc1NC(=O)c1cc(OC)cc(OC)c1.
What is the InChIKey of N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide?
The InChIKey is RIIOZHXJMGHFNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3/c1-4-19-12-13-7-5-6-8-17(13)20-18(21)14-9-15(22-2)11-16(10-14)23-3/h5-11,19H,4,12H2,1-3H3,(H,20,21).
What are the key properties of N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide?
N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide has a molecular weight of 314.39 g/mol, XLogP of 3.07, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide is sourced from PubChem (CID 119438730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).