N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide

C17H20N2O2 — CID 43369477

IUPACN-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide
SMILESCCc1ccc(C(=O)Nc2cccc(OCCN)c2)cc1
InChIInChI=1S/C17H20N2O2/c1-2-13-6-8-14(9-7-13)17(20)19-15-4-3-5-16(12-15)21-11-10-18/h3-9,12H,2,10-11,18H2,1H3,(H,19,20)
InChIKeyWSBASJOWIJYXFR-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.84
Rot. Bonds6

About N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide

N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide (PubChem CID 43369477) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide.

Molecular Properties

Compound NameN-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide
PubChem CID43369477
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide
SMILESCCc1ccc(C(=O)Nc2cccc(OCCN)c2)cc1
InChIInChI=1S/C17H20N2O2/c1-2-13-6-8-14(9-7-13)17(20)19-15-4-3-5-16(12-15)21-11-10-18/h3-9,12H,2,10-11,18H2,1H3,(H,19,20)
InChIKeyWSBASJOWIJYXFR-UHFFFAOYSA-N
XLogP2.84
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(2-aminoethoxy)phenyl]-4-iodobenzamide
CID 63121269
1-N,4-N-bis(3-hexoxyphenyl)benzene-1,4-dicarboxamide
CID 17094971
N-[3-(aminomethyl)phenyl]-4-ethylbenzamide
CID 18072148
N-[3-(2-aminoethoxy)phenyl]-3-chloro-4-hydroxybenzamide
CID 63121177
4-(aminomethyl)-N-(3-methoxyphenyl)benzamide
CID 16796099
4-(chloromethyl)-N-(3-ethoxyphenyl)benzamide
CID 60933770
4-butoxy-N-(3-hexoxyphenyl)benzamide
CID 17094812
N-[3-(2-phenoxyethoxy)phenyl]-4-propoxybenzamide
CID 17123567
N-(3-benzamidophenyl)-4-ethylbenzamide
CID 17102471
4-[4-[(3-propoxyphenyl)carbamoyl]phenoxy]benzamide
CID 56545720
N-[3-(2-aminoethoxy)phenyl]pyridazine-4-carboxamide
CID 104668880
4-hydroxy-N-(3-pentoxyphenyl)benzamide
CID 54418426

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide?
The IUPAC name of N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide (CID 43369477) is N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide.
What is the SMILES notation for N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide?
The canonical SMILES for N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide is CCc1ccc(C(=O)Nc2cccc(OCCN)c2)cc1.
What is the InChIKey of N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide?
The InChIKey is WSBASJOWIJYXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-2-13-6-8-14(9-7-13)17(20)19-15-4-3-5-16(12-15)21-11-10-18/h3-9,12H,2,10-11,18H2,1H3,(H,19,20).
What are the key properties of N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide?
N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide has a molecular weight of 284.36 g/mol, XLogP of 2.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide is sourced from PubChem (CID 43369477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).