6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid

C14H21N3O2 — CID 129470364

IUPAC6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid
SMILESCC(C)N1C[C@@H](C)[C@@H](Nc2cccc(C(=O)O)n2)C1
InChIInChI=1S/C14H21N3O2/c1-9(2)17-7-10(3)12(8-17)16-13-6-4-5-11(15-13)14(18)19/h4-6,9-10,12H,7-8H2,1-3H3,(H,15,16)(H,18,19)/t10-,12+/m1/s1
InChIKeyKNKFRYPQURSTOL-PWSUYJOCSA-N
MW263.34 g/mol
LogP1.92
Rot. Bonds4

About 6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid

6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid (PubChem CID 129470364) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid
PubChem CID129470364
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid
SMILESCC(C)N1C[C@@H](C)[C@@H](Nc2cccc(C(=O)O)n2)C1
InChIInChI=1S/C14H21N3O2/c1-9(2)17-7-10(3)12(8-17)16-13-6-4-5-11(15-13)14(18)19/h4-6,9-10,12H,7-8H2,1-3H3,(H,15,16)(H,18,19)/t10-,12+/m1/s1
InChIKeyKNKFRYPQURSTOL-PWSUYJOCSA-N
XLogP1.92
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid with MolForge

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Related Compounds

6-[(2-methylcyclopropyl)amino]pyridine-2-carboxylic acid
CID 62409955
6-[(2-methoxycyclopentyl)amino]pyridine-2-carboxylic acid
CID 62238707
6-[[1-(3-methylbutanoyl)piperidin-4-yl]amino]pyridine-2-carboxylic acid
CID 122053315
6-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide
CID 130365347
6-[[4-(difluoromethyl)cyclohexyl]amino]pyridine-2-carboxylic acid
CID 122058210
6-[(2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)amino]pyridine-2-carboxylic acid
CID 167770775
N-(1,3-dimethylpiperidin-4-yl)-6-hydrazinylpyridine-2-carboxamide
CID 114505987
6-[[2-(4-chlorophenyl)oxolan-3-yl]amino]pyridine-2-carboxylic acid
CID 122054738
6-[(3,3-dimethylcyclopentyl)amino]pyridine-2-carboxylic acid
CID 114541236
N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-4-propan-2-yl-1,3-oxazole-2-carboxamide
CID 146364145
6-fluoro-N-(1-propan-2-ylazetidin-3-yl)pyridin-2-amine
CID 130620537
6-(but-3-yn-2-ylamino)pyridine-2-carboxylic acid
CID 114417641

Frequently Asked Questions

What is the IUPAC name of 6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid?
The IUPAC name of 6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid (CID 129470364) is 6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid?
The canonical SMILES for 6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid is CC(C)N1C[C@@H](C)[C@@H](Nc2cccc(C(=O)O)n2)C1.
What is the InChIKey of 6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid?
The InChIKey is KNKFRYPQURSTOL-PWSUYJOCSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-9(2)17-7-10(3)12(8-17)16-13-6-4-5-11(15-13)14(18)19/h4-6,9-10,12H,7-8H2,1-3H3,(H,15,16)(H,18,19)/t10-,12+/m1/s1.
What are the key properties of 6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid?
6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid has a molecular weight of 263.34 g/mol, XLogP of 1.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]amino]pyridine-2-carboxylic acid is sourced from PubChem (CID 129470364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).