N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide

C14H14ClN3O2 — CID 166029124

IUPACN-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(Oc2cc(N)nc(Cl)c2)c(C)c1
InChIInChI=1S/C14H14ClN3O2/c1-8-5-10(17-9(2)19)3-4-12(8)20-11-6-13(15)18-14(16)7-11/h3-7H,1-2H3,(H2,16,18)(H,17,19)
InChIKeyFNDXBXAAZDWQNX-UHFFFAOYSA-N
MW291.74 g/mol
LogP3.38
Rot. Bonds3

About N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide

N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide (PubChem CID 166029124) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide
PubChem CID166029124
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC NameN-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(Oc2cc(N)nc(Cl)c2)c(C)c1
InChIInChI=1S/C14H14ClN3O2/c1-8-5-10(17-9(2)19)3-4-12(8)20-11-6-13(15)18-14(16)7-11/h3-7H,1-2H3,(H2,16,18)(H,17,19)
InChIKeyFNDXBXAAZDWQNX-UHFFFAOYSA-N
XLogP3.38
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-[4-[(6-chloro-2-methyl-3-pyridinyl)oxy]phenyl]acetamide
CID 82225235
phenyl N-(3-methyl-4-phenoxyphenyl)carbamate
CID 139442804
2-amino-N-(3-bromo-4-methylphenyl)-6-chloropyridine-4-carboxamide
CID 62871680
ethyl 4-(4-acetamido-2-chlorophenoxy)benzoate
CID 132591036
2-amino-6-chloro-N-(4-methylphenyl)pyridine-4-carboxamide
CID 62156439
N-[3-(2-amino-4-chlorophenoxy)phenyl]acetamide
CID 26189302
2-amino-6-chloro-N-(4-methyl-3-nitrophenyl)pyridine-4-carboxamide
CID 62153244
1-amino-N-(3-methyl-4-pyridin-3-yloxyphenyl)cyclopentane-1-carboxamide;dihydrochloride
CID 119864481
[3-methyl-4-(4-nitrophenoxy)phenyl]carbamic acid
CID 69145418
2-amino-6-chloro-N-(4-methoxy-2-methylphenyl)pyridine-4-carboxamide
CID 62872287
N-(3-methyl-4-pyridin-3-yloxyphenyl)-3-phenylprop-2-ynamide
CID 166220719
1-(3-methyl-4-phenoxyphenyl)-3-(1-phenylpyrazol-4-yl)urea
CID 139434229

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide?
The IUPAC name of N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide (CID 166029124) is N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide.
What is the SMILES notation for N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide?
The canonical SMILES for N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide is CC(=O)Nc1ccc(Oc2cc(N)nc(Cl)c2)c(C)c1.
What is the InChIKey of N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide?
The InChIKey is FNDXBXAAZDWQNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c1-8-5-10(17-9(2)19)3-4-12(8)20-11-6-13(15)18-14(16)7-11/h3-7H,1-2H3,(H2,16,18)(H,17,19).
What are the key properties of N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide?
N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide has a molecular weight of 291.74 g/mol, XLogP of 3.38, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-amino-6-chloro-4-pyridinyl)oxy]-3-methylphenyl]acetamide is sourced from PubChem (CID 166029124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).