N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide

C16H18N2O3 — CID 43672974

IUPACN-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide
SMILESCOc1cc(NCc2cccc(O)c2)ccc1NC(C)=O
InChIInChI=1S/C16H18N2O3/c1-11(19)18-15-7-6-13(9-16(15)21-2)17-10-12-4-3-5-14(20)8-12/h3-9,17,20H,10H2,1-2H3,(H,18,19)
InChIKeyILRKFHULWRBJKK-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.97
Rot. Bonds5

About N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide

N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide (PubChem CID 43672974) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide
PubChem CID43672974
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide
SMILESCOc1cc(NCc2cccc(O)c2)ccc1NC(C)=O
InChIInChI=1S/C16H18N2O3/c1-11(19)18-15-7-6-13(9-16(15)21-2)17-10-12-4-3-5-14(20)8-12/h3-9,17,20H,10H2,1-2H3,(H,18,19)
InChIKeyILRKFHULWRBJKK-UHFFFAOYSA-N
XLogP2.97
TPSA70.59 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 ≤ 52.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-chloro-4-[(3-hydroxyphenyl)methylamino]phenyl]acetamide
CID 43690205
methyl N-[2-fluoro-4-[(3-hydroxyphenyl)methylamino]phenyl]carbamate
CID 84600677
3-[(3-fluoro-4-methoxyanilino)methyl]phenol
CID 43380515
N-[4-[(3-ethoxyphenyl)methylamino]-2-methoxyphenyl]-2-methylpropanamide
CID 851541
N-[4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylamino]-2-methoxyphenyl]acetamide
CID 78885123
N-[2-methoxy-4-[(5-methyl-2-pyridinyl)methylamino]phenyl]acetamide
CID 80711477
3-[(3-hydroxyanilino)methyl]phenol
CID 21321439
N-[2-methoxy-4-[(4-methyl-1,3-thiazol-2-yl)methylamino]phenyl]acetamide
CID 115633701
N-[4-[[5-chloro-2-(pyridin-3-ylmethoxy)phenyl]methylamino]-2-methoxyphenyl]acetamide
CID 78895433
3-[(4-methoxy-3-methylphenyl)methylamino]phenol
CID 43771044
N-[4-[(3-hydroxyphenyl)methylamino]phenyl]-2-methylpropanamide
CID 43683747
N-[3-[(3-fluorophenyl)methylamino]-4-methoxyphenyl]acetamide
CID 24583317

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide?
The IUPAC name of N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide (CID 43672974) is N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide.
What is the SMILES notation for N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide?
The canonical SMILES for N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide is COc1cc(NCc2cccc(O)c2)ccc1NC(C)=O.
What is the InChIKey of N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide?
The InChIKey is ILRKFHULWRBJKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-11(19)18-15-7-6-13(9-16(15)21-2)17-10-12-4-3-5-14(20)8-12/h3-9,17,20H,10H2,1-2H3,(H,18,19).
What are the key properties of N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide?
N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide has a molecular weight of 286.33 g/mol, XLogP of 2.97, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-hydroxyphenyl)methylamino]-2-methoxyphenyl]acetamide is sourced from PubChem (CID 43672974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).