2-[ethyl(propyl)amino]pyridine-4-carboxylic acid

C11H16N2O2 — CID 43269021

IUPAC2-[ethyl(propyl)amino]pyridine-4-carboxylic acid
SMILESCCCN(CC)c1cc(C(=O)O)ccn1
InChIInChI=1S/C11H16N2O2/c1-3-7-13(4-2)10-8-9(11(14)15)5-6-12-10/h5-6,8H,3-4,7H2,1-2H3,(H,14,15)
InChIKeyKKYCASDSPOVFMA-UHFFFAOYSA-N
MW208.26 g/mol
LogP2.02
Rot. Bonds5

About 2-[ethyl(propyl)amino]pyridine-4-carboxylic acid

2-[ethyl(propyl)amino]pyridine-4-carboxylic acid (PubChem CID 43269021) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-[ethyl(propyl)amino]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-[ethyl(propyl)amino]pyridine-4-carboxylic acid
PubChem CID43269021
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-[ethyl(propyl)amino]pyridine-4-carboxylic acid
SMILESCCCN(CC)c1cc(C(=O)O)ccn1
InChIInChI=1S/C11H16N2O2/c1-3-7-13(4-2)10-8-9(11(14)15)5-6-12-10/h5-6,8H,3-4,7H2,1-2H3,(H,14,15)
InChIKeyKKYCASDSPOVFMA-UHFFFAOYSA-N
XLogP2.02
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(dimethylamino)-2-oxoethyl]-propylamino]pyridine-4-carboxylic acid
CID 54990300
2-[[2-(methylamino)-2-oxoethyl]-propylamino]pyridine-4-carboxylic acid
CID 54984974
2-[cyclopropylmethyl(propyl)amino]pyridine-4-carboxylic acid
CID 61443100
2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-4-carboxylic acid
CID 54948629
4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine
CID 142584309
2-[ethyl(methyl)amino]pyridine-4-carboxylic acid
CID 43263657
2-[bis(2-ethoxyethyl)amino]pyridine-4-carboxylic acid
CID 82960357
N-tert-butyl-2-(dipropylamino)pyridine-4-carboxamide
CID 109174998
2-[methyl(2-methylbutan-2-yl)amino]pyridine-4-carboxylic acid
CID 63957871
2-[butyl(cyclopropyl)amino]pyridine-4-carboxylic acid
CID 61442819
N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide
CID 109175949
N-(4-bromophenyl)-2-(dipropylamino)pyridine-4-carboxamide
CID 109175913

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(propyl)amino]pyridine-4-carboxylic acid?
The IUPAC name of 2-[ethyl(propyl)amino]pyridine-4-carboxylic acid (CID 43269021) is 2-[ethyl(propyl)amino]pyridine-4-carboxylic acid.
What is the SMILES notation for 2-[ethyl(propyl)amino]pyridine-4-carboxylic acid?
The canonical SMILES for 2-[ethyl(propyl)amino]pyridine-4-carboxylic acid is CCCN(CC)c1cc(C(=O)O)ccn1.
What is the InChIKey of 2-[ethyl(propyl)amino]pyridine-4-carboxylic acid?
The InChIKey is KKYCASDSPOVFMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-3-7-13(4-2)10-8-9(11(14)15)5-6-12-10/h5-6,8H,3-4,7H2,1-2H3,(H,14,15).
What are the key properties of 2-[ethyl(propyl)amino]pyridine-4-carboxylic acid?
2-[ethyl(propyl)amino]pyridine-4-carboxylic acid has a molecular weight of 208.26 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(propyl)amino]pyridine-4-carboxylic acid is sourced from PubChem (CID 43269021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).