ethyl 2-amino-5-ethylpyridine-3-carboxylate

C10H14N2O2 — CID 155887465

IUPACethyl 2-amino-5-ethylpyridine-3-carboxylate
SMILESCCOC(=O)c1cc(CC)cnc1N
InChIInChI=1S/C10H14N2O2/c1-3-7-5-8(9(11)12-6-7)10(13)14-4-2/h5-6H,3-4H2,1-2H3,(H2,11,12)
InChIKeyXJVHTJXQQRDZLP-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.40
Rot. Bonds3

About ethyl 2-amino-5-ethylpyridine-3-carboxylate

ethyl 2-amino-5-ethylpyridine-3-carboxylate (PubChem CID 155887465) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is ethyl 2-amino-5-ethylpyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 2-amino-5-ethylpyridine-3-carboxylate
PubChem CID155887465
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Nameethyl 2-amino-5-ethylpyridine-3-carboxylate
SMILESCCOC(=O)c1cc(CC)cnc1N
InChIInChI=1S/C10H14N2O2/c1-3-7-5-8(9(11)12-6-7)10(13)14-4-2/h5-6H,3-4H2,1-2H3,(H2,11,12)
InChIKeyXJVHTJXQQRDZLP-UHFFFAOYSA-N
XLogP1.40
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-tert-butyl-5-ethylpyridine-3-carboxylate
CID 116533791
6-amino-5-ethoxycarbonylpyridine-3-carboxylic acid
CID 170903103
ethyl 3,5-diethylpyridine-2-carboxylate
CID 67884033
diethyl 5-(bromomethyl)pyridine-2,3-dicarboxylate
CID 141448737
diethyl 5-propylpyridine-2,3-dicarboxylate
CID 14097634
ethyl 2-amino-5-(2-oxopiperidin-1-yl)pyridine-3-carboxylate
CID 53419442
ethyl 5-(bromomethyl)-2-(difluoromethyl)pyridine-3-carboxylate
CID 130098245
diethyl pyrimidine-4,5-dicarboxylate
CID 13000769
ethyl 6-amino-5-iodopyridine-3-carboxylate
CID 67057368
diethyl phthalazine-6,7-dicarboxylate
CID 13115748
ethyl 1-amino-2,7-naphthyridine-4-carboxylate
CID 73425222
ethyl 5,6-diamino-2-methylpyridine-3-carboxylate
CID 170959467

Frequently Asked Questions

What is the IUPAC name of ethyl 2-amino-5-ethylpyridine-3-carboxylate?
The IUPAC name of ethyl 2-amino-5-ethylpyridine-3-carboxylate (CID 155887465) is ethyl 2-amino-5-ethylpyridine-3-carboxylate.
What is the SMILES notation for ethyl 2-amino-5-ethylpyridine-3-carboxylate?
The canonical SMILES for ethyl 2-amino-5-ethylpyridine-3-carboxylate is CCOC(=O)c1cc(CC)cnc1N.
What is the InChIKey of ethyl 2-amino-5-ethylpyridine-3-carboxylate?
The InChIKey is XJVHTJXQQRDZLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-3-7-5-8(9(11)12-6-7)10(13)14-4-2/h5-6H,3-4H2,1-2H3,(H2,11,12).
What are the key properties of ethyl 2-amino-5-ethylpyridine-3-carboxylate?
ethyl 2-amino-5-ethylpyridine-3-carboxylate has a molecular weight of 194.23 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-amino-5-ethylpyridine-3-carboxylate is sourced from PubChem (CID 155887465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).