6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid

C14H15N3O2 — CID 81233304

IUPAC6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid
SMILESCc1cc(NCCc2ccccn2)c(C(=O)O)cn1
InChIInChI=1S/C14H15N3O2/c1-10-8-13(12(9-17-10)14(18)19)16-7-5-11-4-2-3-6-15-11/h2-4,6,8-9H,5,7H2,1H3,(H,16,17)(H,18,19)
InChIKeyFADLNNBODUYXKM-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.14
Rot. Bonds5

About 6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid

6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid (PubChem CID 81233304) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid
PubChem CID81233304
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid
SMILESCc1cc(NCCc2ccccn2)c(C(=O)O)cn1
InChIInChI=1S/C14H15N3O2/c1-10-8-13(12(9-17-10)14(18)19)16-7-5-11-4-2-3-6-15-11/h2-4,6,8-9H,5,7H2,1H3,(H,16,17)(H,18,19)
InChIKeyFADLNNBODUYXKM-UHFFFAOYSA-N
XLogP2.14
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-[2-(2-pyridin-2-ylethylamino)phenyl]pyrazine-2-carboxamide
CID 86814979
4-(but-3-ynylamino)-6-methylpyridine-3-carboxylic acid
CID 81244685
6-methyl-4-[[3-(methylamino)-3-oxopropyl]amino]pyridine-3-carboxylic acid
CID 81243971
2-amino-5-(2-pyridin-2-ylethylamino)benzoic acid
CID 60989382
6-methyl-4-[methyl(pyridin-2-ylmethyl)amino]pyridine-3-carboxylic acid
CID 81232216
4-amino-3-(2-pyridin-2-ylethylamino)benzoic acid
CID 82785039
4-[2-(cyclohexen-1-yl)ethylamino]-6-methylpyridine-3-carboxylic acid
CID 114009317
2-(2-pyridin-2-ylethylamino)benzamide
CID 70453940
6-methyl-4-[(3-methyl-2-propan-2-ylbutyl)amino]pyridine-3-carboxylic acid
CID 102906554
4-methyl-2-(pyridin-2-ylmethylamino)benzoic acid
CID 55107787
6-methyl-4-(methylamino)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 81236822
6-methyl-4-(prop-2-ynylamino)pyridine-3-carboxylic acid
CID 81232269

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid?
The IUPAC name of 6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid (CID 81233304) is 6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid.
What is the SMILES notation for 6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid?
The canonical SMILES for 6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid is Cc1cc(NCCc2ccccn2)c(C(=O)O)cn1.
What is the InChIKey of 6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid?
The InChIKey is FADLNNBODUYXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-10-8-13(12(9-17-10)14(18)19)16-7-5-11-4-2-3-6-15-11/h2-4,6,8-9H,5,7H2,1H3,(H,16,17)(H,18,19).
What are the key properties of 6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid?
6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid has a molecular weight of 257.29 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-(2-pyridin-2-ylethylamino)pyridine-3-carboxylic acid is sourced from PubChem (CID 81233304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).