ethyl 2-amino-6-phenylpyridine-3-carboxylate

C14H14N2O2 — CID 1236695

IUPACethyl 2-amino-6-phenylpyridine-3-carboxylate
SMILESCCOC(=O)c1ccc(-c2ccccc2)nc1N
InChIInChI=1S/C14H14N2O2/c1-2-18-14(17)11-8-9-12(16-13(11)15)10-6-4-3-5-7-10/h3-9H,2H2,1H3,(H2,15,16)
InChIKeyGHMCWQCNJNHUKQ-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.51
Rot. Bonds3

About ethyl 2-amino-6-phenylpyridine-3-carboxylate

ethyl 2-amino-6-phenylpyridine-3-carboxylate (PubChem CID 1236695) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is ethyl 2-amino-6-phenylpyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 2-amino-6-phenylpyridine-3-carboxylate
PubChem CID1236695
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Nameethyl 2-amino-6-phenylpyridine-3-carboxylate
SMILESCCOC(=O)c1ccc(-c2ccccc2)nc1N
InChIInChI=1S/C14H14N2O2/c1-2-18-14(17)11-8-9-12(16-13(11)15)10-6-4-3-5-7-10/h3-9H,2H2,1H3,(H2,15,16)
InChIKeyGHMCWQCNJNHUKQ-UHFFFAOYSA-N
XLogP2.51
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2,6-diaminopyridine-3-carboxylate
CID 58784252
ethyl 8-methyl-2-phenylquinoline-6-carboxylate
CID 164676553
[2-[di(propan-2-yl)amino]-2-oxoethyl] 2-methyl-6-phenylpyridine-3-carboxylate
CID 55463613
ethyl 2-methyl-6-pyridin-3-ylpyridine-3-carboxylate
CID 112561966
ethyl 2-phenyl-9H-pyrido[2,3-b]indole-5-carboxylate
CID 11652603
ethyl 2-ethyl-6-(3-methylphenyl)pyridine-3-carboxylate
CID 116532844
2-ethyl-6-phenylpyridine-3-carboxylic acid
CID 91810897
ethyl 6-(4-chlorophenyl)-2-ethylpyridine-3-carboxylate
CID 116532919
ethyl 6-(4-ethoxyphenyl)-2-methylpyridine-3-carboxylate
CID 115917504
ethyl 3-amino-2-(methylamino)-6-(4-phenylphenyl)pyridine-4-carboxylate
CID 10315680
ethyl 6-(3-chlorophenyl)-2-propan-2-ylpyridine-3-carboxylate
CID 116533326
ethyl 5-methyl-6-phenyl-2-propan-2-ylpyridine-3-carboxylate
CID 116533372

Frequently Asked Questions

What is the IUPAC name of ethyl 2-amino-6-phenylpyridine-3-carboxylate?
The IUPAC name of ethyl 2-amino-6-phenylpyridine-3-carboxylate (CID 1236695) is ethyl 2-amino-6-phenylpyridine-3-carboxylate.
What is the SMILES notation for ethyl 2-amino-6-phenylpyridine-3-carboxylate?
The canonical SMILES for ethyl 2-amino-6-phenylpyridine-3-carboxylate is CCOC(=O)c1ccc(-c2ccccc2)nc1N.
What is the InChIKey of ethyl 2-amino-6-phenylpyridine-3-carboxylate?
The InChIKey is GHMCWQCNJNHUKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-2-18-14(17)11-8-9-12(16-13(11)15)10-6-4-3-5-7-10/h3-9H,2H2,1H3,(H2,15,16).
What are the key properties of ethyl 2-amino-6-phenylpyridine-3-carboxylate?
ethyl 2-amino-6-phenylpyridine-3-carboxylate has a molecular weight of 242.28 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-amino-6-phenylpyridine-3-carboxylate is sourced from PubChem (CID 1236695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).