methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate

C10H14N2O2 — CID 115019771

IUPACmethyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate
SMILESCCc1ncc(N)c(C(=O)OC)c1C
InChIInChI=1S/C10H14N2O2/c1-4-8-6(2)9(10(13)14-3)7(11)5-12-8/h5H,4,11H2,1-3H3
InChIKeyZGLFQIKITMNICI-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.32
Rot. Bonds2

About methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate

methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate (PubChem CID 115019771) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate.

Molecular Properties

Compound Namemethyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate
PubChem CID115019771
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Namemethyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate
SMILESCCc1ncc(N)c(C(=O)OC)c1C
InChIInChI=1S/C10H14N2O2/c1-4-8-6(2)9(10(13)14-3)7(11)5-12-8/h5H,4,11H2,1-3H3
InChIKeyZGLFQIKITMNICI-UHFFFAOYSA-N
XLogP1.32
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate?
The IUPAC name of methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate (CID 115019771) is methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate.
What is the SMILES notation for methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate?
The canonical SMILES for methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate is CCc1ncc(N)c(C(=O)OC)c1C.
What is the InChIKey of methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate?
The InChIKey is ZGLFQIKITMNICI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-4-8-6(2)9(10(13)14-3)7(11)5-12-8/h5H,4,11H2,1-3H3.
What are the key properties of methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate?
methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate has a molecular weight of 194.23 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-amino-2-ethyl-3-methylpyridine-4-carboxylate is sourced from PubChem (CID 115019771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).