N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide

C11H16N2O2 — CID 67557905

IUPACN-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide
SMILESCNc1ccc(OC)c(CNC(C)=O)c1
InChIInChI=1S/C11H16N2O2/c1-8(14)13-7-9-6-10(12-2)4-5-11(9)15-3/h4-6,12H,7H2,1-3H3,(H,13,14)
InChIKeyQJCHREVEAMYIKE-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.37
Rot. Bonds4

About N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide

N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide (PubChem CID 67557905) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide
PubChem CID67557905
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide
SMILESCNc1ccc(OC)c(CNC(C)=O)c1
InChIInChI=1S/C11H16N2O2/c1-8(14)13-7-9-6-10(12-2)4-5-11(9)15-3/h4-6,12H,7H2,1-3H3,(H,13,14)
InChIKeyQJCHREVEAMYIKE-UHFFFAOYSA-N
XLogP1.37
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

N-[(2-methoxy-5-methylphenyl)methyl]acetamide
CID 110779845
N-[(2-methoxy-5-propan-2-ylphenyl)methyl]acetamide
CID 110780628
N-[(2-methoxy-5-nitrophenyl)methyl]acetamide
CID 20650534
N-[2-(dimethylamino)ethyl]-2-[2-methoxy-5-(methylamino)phenyl]acetamide
CID 10730419
N-[(5-acetamido-2-methoxyphenyl)methyl]-3-methylbutanamide
CID 110784111
N-[2-methoxy-5-(methylamino)phenyl]acetamide
CID 82649039
N-[4-methoxy-3-[(propan-2-ylamino)methyl]phenyl]acetamide
CID 96661325
N-[(5-acetamido-2-methoxyphenyl)methyl]-4-fluorobenzamide
CID 110784125
N-[3-(hydroxymethyl)-4-methoxyphenyl]acetamide
CID 82469130
N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
CID 18425632
N-[(5-acetamido-2-methoxyphenyl)methyl]-2-(2-chlorophenyl)acetamide
CID 110784166
N-[(5-acetamido-2-methoxyphenyl)methyl]-3-(dimethylamino)benzamide
CID 110794429

Frequently Asked Questions

What is the IUPAC name of N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide?
The IUPAC name of N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide (CID 67557905) is N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide.
What is the SMILES notation for N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide?
The canonical SMILES for N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide is CNc1ccc(OC)c(CNC(C)=O)c1.
What is the InChIKey of N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide?
The InChIKey is QJCHREVEAMYIKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-8(14)13-7-9-6-10(12-2)4-5-11(9)15-3/h4-6,12H,7H2,1-3H3,(H,13,14).
What are the key properties of N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide?
N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide has a molecular weight of 208.26 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-methoxy-5-(methylamino)phenyl]methyl]acetamide is sourced from PubChem (CID 67557905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).