4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide

C17H20N2O2 — CID 107675620

IUPAC4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide
SMILESCNC(C)c1cccc(NC(=O)c2ccc(O)c(C)c2)c1
InChIInChI=1S/C17H20N2O2/c1-11-9-14(7-8-16(11)20)17(21)19-15-6-4-5-13(10-15)12(2)18-3/h4-10,12,18,20H,1-3H3,(H,19,21)
InChIKeyAXMIORVQHQKLPE-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.23
Rot. Bonds4

About 4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide

4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide (PubChem CID 107675620) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide.

Molecular Properties

Compound Name4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide
PubChem CID107675620
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide
SMILESCNC(C)c1cccc(NC(=O)c2ccc(O)c(C)c2)c1
InChIInChI=1S/C17H20N2O2/c1-11-9-14(7-8-16(11)20)17(21)19-15-6-4-5-13(10-15)12(2)18-3/h4-10,12,18,20H,1-3H3,(H,19,21)
InChIKeyAXMIORVQHQKLPE-UHFFFAOYSA-N
XLogP3.23
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dimethyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide
CID 43507770
N-(3-acetylphenyl)-4-hydroxy-3-methylbenzamide
CID 103955356
2,3-dimethyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide
CID 43507775
N-[3-[1-(methylamino)ethyl]phenyl]acetamide
CID 43200396
4-hydroxy-3-methyl-N-[3-(trifluoromethyl)phenyl]benzamide
CID 103955327
2-methyl-N-[3-[1-(methylamino)ethyl]phenyl]propanamide
CID 43507738
N-(3-chloro-4-methylphenyl)-4-hydroxy-3-methylbenzamide
CID 103951695
2,4,5-trimethyl-N-[3-[1-(methylamino)ethyl]phenyl]furan-3-carboxamide
CID 65151530
2-methyl-N-[3-[1-(methylamino)ethyl]phenyl]furan-3-carboxamide
CID 43507800
3-chloro-N-[3-(1-hydroxyethyl)phenyl]-4-methylbenzamide
CID 91676950
N-[3-(3-aminopropyl)phenyl]-4-hydroxy-3-methylbenzamide
CID 107673369
2-methyl-N-[3-[1-(methylamino)ethyl]phenyl]butanamide
CID 43507778

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide?
The IUPAC name of 4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide (CID 107675620) is 4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide.
What is the SMILES notation for 4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide?
The canonical SMILES for 4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide is CNC(C)c1cccc(NC(=O)c2ccc(O)c(C)c2)c1.
What is the InChIKey of 4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide?
The InChIKey is AXMIORVQHQKLPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-11-9-14(7-8-16(11)20)17(21)19-15-6-4-5-13(10-15)12(2)18-3/h4-10,12,18,20H,1-3H3,(H,19,21).
What are the key properties of 4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide?
4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide has a molecular weight of 284.36 g/mol, XLogP of 3.23, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-methyl-N-[3-[1-(methylamino)ethyl]phenyl]benzamide is sourced from PubChem (CID 107675620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).