3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide

C17H20N2O2 — CID 43507956

IUPAC3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide
SMILESCNC(C)c1ccccc1NC(=O)c1cccc(OC)c1
InChIInChI=1S/C17H20N2O2/c1-12(18-2)15-9-4-5-10-16(15)19-17(20)13-7-6-8-14(11-13)21-3/h4-12,18H,1-3H3,(H,19,20)
InChIKeyWANDQBNSHFGMLB-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.23
Rot. Bonds5

About 3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide

3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide (PubChem CID 43507956) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide
PubChem CID43507956
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide
SMILESCNC(C)c1ccccc1NC(=O)c1cccc(OC)c1
InChIInChI=1S/C17H20N2O2/c1-12(18-2)15-9-4-5-10-16(15)19-17(20)13-7-6-8-14(11-13)21-3/h4-12,18H,1-3H3,(H,19,20)
InChIKeyWANDQBNSHFGMLB-UHFFFAOYSA-N
XLogP3.23
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1-chloroethyl)phenyl]-3-methoxybenzamide
CID 114304807
3-hydroxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide
CID 43507958
3-methyl-N-[2-[1-(methylamino)ethyl]phenyl]benzamide
CID 43507964
N-[2-[bis(4-hydroxyphenyl)methyl]phenyl]-3-methoxybenzamide
CID 19938149
3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide
CID 46756320
3-ethoxy-N-(2-propan-2-ylphenyl)benzamide
CID 799138
2-[(3-methoxybenzoyl)amino]-N-(3-methoxyphenyl)benzamide
CID 51154923
N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide
CID 35368167
5-methyl-N-[2-[1-(methylamino)ethyl]phenyl]furan-3-carboxamide
CID 114819295
2-hydroxy-3-[(3-methoxybenzoyl)amino]benzoic acid
CID 104832964
N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide
CID 17417921
N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide
CID 2670827

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide?
The IUPAC name of 3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide (CID 43507956) is 3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide?
The canonical SMILES for 3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide is CNC(C)c1ccccc1NC(=O)c1cccc(OC)c1.
What is the InChIKey of 3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide?
The InChIKey is WANDQBNSHFGMLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12(18-2)15-9-4-5-10-16(15)19-17(20)13-7-6-8-14(11-13)21-3/h4-12,18H,1-3H3,(H,19,20).
What are the key properties of 3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide?
3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide has a molecular weight of 284.36 g/mol, XLogP of 3.23, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide is sourced from PubChem (CID 43507956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).