2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid

C14H20N2O2 — CID 79351085

IUPAC2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid
SMILESCC1(C)C(CNc2ncccc2C(=O)O)C1(C)C
InChIInChI=1S/C14H20N2O2/c1-13(2)10(14(13,3)4)8-16-11-9(12(17)18)6-5-7-15-11/h5-7,10H,8H2,1-4H3,(H,15,16)(H,17,18)
InChIKeyAPTRPRASGMVWJE-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.87
Rot. Bonds4

About 2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid

2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid (PubChem CID 79351085) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid
PubChem CID79351085
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid
SMILESCC1(C)C(CNc2ncccc2C(=O)O)C1(C)C
InChIInChI=1S/C14H20N2O2/c1-13(2)10(14(13,3)4)8-16-11-9(12(17)18)6-5-7-15-11/h5-7,10H,8H2,1-4H3,(H,15,16)(H,17,18)
InChIKeyAPTRPRASGMVWJE-UHFFFAOYSA-N
XLogP2.87
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-chloro-2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-4-carboxylic acid
CID 107062793
2-(2-oxopropylamino)pyridine-3-carboxylic acid
CID 89326661
2-[(2-methylcyclohexyl)methylamino]pyridine-3-carboxylic acid
CID 63511863
2-(hexylamino)pyridine-3-carboxylic acid
CID 14222051
2-[(4-ethylphenyl)methylamino]pyridine-3-carboxylic acid
CID 106900004
2-(3-phenylpropylamino)pyridine-3-carboxylic acid
CID 60654935
2-[2-(methanesulfonamido)ethylamino]pyridine-3-carboxylic acid
CID 43420764
2-(3-butoxypropylamino)pyridine-3-carboxylic acid
CID 82341813
2-[(2-methyl-3-methylsulfanylpropyl)amino]pyridine-3-carboxylic acid
CID 63960048
2-(2-cyclopentylethylamino)pyridine-3-carboxylic acid
CID 60731921
2-(2-methylbutanoylamino)pyridine-3-carboxylic acid
CID 63654439
2-(butylamino)pyridine-3-carboxamide
CID 29031037

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid?
The IUPAC name of 2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid (CID 79351085) is 2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid.
What is the SMILES notation for 2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid?
The canonical SMILES for 2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid is CC1(C)C(CNc2ncccc2C(=O)O)C1(C)C.
What is the InChIKey of 2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid?
The InChIKey is APTRPRASGMVWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-13(2)10(14(13,3)4)8-16-11-9(12(17)18)6-5-7-15-11/h5-7,10H,8H2,1-4H3,(H,15,16)(H,17,18).
What are the key properties of 2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid?
2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid has a molecular weight of 248.33 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-3-carboxylic acid is sourced from PubChem (CID 79351085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).