(2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone

C15H16N2O2 — CID 113330341

IUPAC(2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone
SMILESCCOc1ccccc1C(=O)c1c(C)ccnc1N
InChIInChI=1S/C15H16N2O2/c1-3-19-12-7-5-4-6-11(12)14(18)13-10(2)8-9-17-15(13)16/h4-9H,3H2,1-2H3,(H2,16,17)
InChIKeyAGOLMXPAFLUHMU-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.60
Rot. Bonds4

About (2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone

(2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone (PubChem CID 113330341) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is (2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone.

Molecular Properties

Compound Name(2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone
PubChem CID113330341
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name(2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone
SMILESCCOc1ccccc1C(=O)c1c(C)ccnc1N
InChIInChI=1S/C15H16N2O2/c1-3-19-12-7-5-4-6-11(12)14(18)13-10(2)8-9-17-15(13)16/h4-9H,3H2,1-2H3,(H2,16,17)
InChIKeyAGOLMXPAFLUHMU-UHFFFAOYSA-N
XLogP2.60
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-amino-4-methyl-3-pyridinyl)-2-ethoxybutan-1-one
CID 116707609
(2-ethoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanone
CID 103433024
(2-ethoxyphenyl)-(1H-imidazol-2-yl)methanone
CID 112731515
(2-aminophenyl)-(4-ethoxy-2,3,6-trimethylphenyl)methanone
CID 82266269
[2-(2-ethoxybenzoyl)phenyl] hydrogen carbonate
CID 174463979
(4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanone
CID 114971145
(2,5-dibromo-4-methylphenyl)-(2-ethoxyphenyl)methanone
CID 81467462
2-(2-amino-4-pyridinyl)-1-(2-ethoxyphenyl)ethanone
CID 115533428
2-ethoxybenzoic acid;zinc
CID 172723273
2-ethoxybenzenecarboperoxoic acid
CID 22314606
2-ethoxybenzoyl bromide
CID 19426336
2-amino-1-(2-ethoxyphenyl)butan-1-one
CID 116583912

Frequently Asked Questions

What is the IUPAC name of (2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone?
The IUPAC name of (2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone (CID 113330341) is (2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone.
What is the SMILES notation for (2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone?
The canonical SMILES for (2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone is CCOc1ccccc1C(=O)c1c(C)ccnc1N.
What is the InChIKey of (2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone?
The InChIKey is AGOLMXPAFLUHMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-3-19-12-7-5-4-6-11(12)14(18)13-10(2)8-9-17-15(13)16/h4-9H,3H2,1-2H3,(H2,16,17).
What are the key properties of (2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone?
(2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone has a molecular weight of 256.31 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-4-methyl-3-pyridinyl)-(2-ethoxyphenyl)methanone is sourced from PubChem (CID 113330341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).