N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide

C16H18N2O3 — CID 82809720

IUPACN-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide
SMILESCc1c(O)cccc1C(=O)Nc1ccccc1OCCN
InChIInChI=1S/C16H18N2O3/c1-11-12(5-4-7-14(11)19)16(20)18-13-6-2-3-8-15(13)21-10-9-17/h2-8,19H,9-10,17H2,1H3,(H,18,20)
InChIKeyWXJBMSSLTLLZNL-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.29
Rot. Bonds5

About N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide

N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide (PubChem CID 82809720) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide.

Molecular Properties

Compound NameN-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide
PubChem CID82809720
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide
SMILESCc1c(O)cccc1C(=O)Nc1ccccc1OCCN
InChIInChI=1S/C16H18N2O3/c1-11-12(5-4-7-14(11)19)16(20)18-13-6-2-3-8-15(13)21-10-9-17/h2-8,19H,9-10,17H2,1H3,(H,18,20)
InChIKeyWXJBMSSLTLLZNL-UHFFFAOYSA-N
XLogP2.29
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2-aminoethoxy)phenyl]-2,6-dihydroxybenzamide
CID 107687422
N-[2-(2-aminoethoxy)phenyl]-2,5-dihydroxybenzamide
CID 107721250
N-[2-(2-aminoethoxy)phenyl]-1,5-dimethylpyrazole-4-carboxamide
CID 43175580
3-hydroxy-2-methyl-N-(2-methylphenyl)benzamide
CID 82786919
3-(2-aminoethoxy)-2-methylphenol
CID 83620006
N-[4-(aminomethyl)-2-methoxyphenyl]-3-hydroxy-2-methylbenzamide
CID 104847667
3-hydroxy-N-[2-(hydroxymethyl)phenyl]-2-methylbenzamide
CID 82828984
tert-butyl N-[2-(2-aminoethoxy)phenyl]carbamate
CID 22620024
3-hydroxy-2-methyl-N-(2-methyl-3-pyridinyl)benzamide
CID 82829673
N-[2-(2-aminoethoxy)phenyl]-2-ethylbutanamide
CID 43369538
N-(2-ethoxyphenyl)-2-(2-methoxyethoxy)benzamide
CID 15943045
1-[2-(2-aminoethoxy)phenyl]-3-(2-fluorophenyl)urea
CID 43175667

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide?
The IUPAC name of N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide (CID 82809720) is N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide.
What is the SMILES notation for N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide?
The canonical SMILES for N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide is Cc1c(O)cccc1C(=O)Nc1ccccc1OCCN.
What is the InChIKey of N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide?
The InChIKey is WXJBMSSLTLLZNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-11-12(5-4-7-14(11)19)16(20)18-13-6-2-3-8-15(13)21-10-9-17/h2-8,19H,9-10,17H2,1H3,(H,18,20).
What are the key properties of N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide?
N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide has a molecular weight of 286.33 g/mol, XLogP of 2.29, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-aminoethoxy)phenyl]-3-hydroxy-2-methylbenzamide is sourced from PubChem (CID 82809720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).