N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide

C11H16N2O2 — CID 70891086

IUPACN-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide
SMILESCNCc1ccc(C(=O)NCCO)cc1
InChIInChI=1S/C11H16N2O2/c1-12-8-9-2-4-10(5-3-9)11(15)13-6-7-14/h2-5,12,14H,6-8H2,1H3,(H,13,15)
InChIKeyAQPPJSXDTYCURR-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.13
Rot. Bonds5

About N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide

N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide (PubChem CID 70891086) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide
PubChem CID70891086
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide
SMILESCNCc1ccc(C(=O)NCCO)cc1
InChIInChI=1S/C11H16N2O2/c1-12-8-9-2-4-10(5-3-9)11(15)13-6-7-14/h2-5,12,14H,6-8H2,1H3,(H,13,15)
InChIKeyAQPPJSXDTYCURR-UHFFFAOYSA-N
XLogP0.13
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(bromomethyl)-N-(2-hydroxyethyl)benzamide
CID 82110896
4-(methylaminomethyl)-N-(2-piperazin-1-ylethyl)benzamide
CID 90338095
N-[2-(2-hexoxyethoxy)ethyl]-4-(methylaminomethyl)benzamide
CID 90338093
N,N-dimethyl-4-(methylaminomethyl)benzamide
CID 155590632
4-amino-N-(2-hydroxyethyl)benzamide;ethane;molecular hydrogen
CID 156799285
4-ethyl-N-[2-(methylamino)ethyl]benzamide;hydrochloride
CID 119499870
methane;4-(methylaminomethyl)benzoic acid
CID 159753139
4-ethylsulfonyl-N-(2-hydroxyethyl)benzamide
CID 96664940
4-(methylaminomethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 90338069
N-(2-hydroxyethyl)-4-[(4-methylpiperazin-1-yl)methyl]benzamide
CID 110903134
4-(4-aminobutyl)-N-(2-hydroxyethyl)benzamide;hydrochloride
CID 67368150
4-[(2-methylhydrazinyl)methyl]-N-pentylbenzamide
CID 54400286

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide?
The IUPAC name of N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide (CID 70891086) is N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide.
What is the SMILES notation for N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide?
The canonical SMILES for N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide is CNCc1ccc(C(=O)NCCO)cc1.
What is the InChIKey of N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide?
The InChIKey is AQPPJSXDTYCURR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-12-8-9-2-4-10(5-3-9)11(15)13-6-7-14/h2-5,12,14H,6-8H2,1H3,(H,13,15).
What are the key properties of N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide?
N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide has a molecular weight of 208.26 g/mol, XLogP of 0.13, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-4-(methylaminomethyl)benzamide is sourced from PubChem (CID 70891086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).