4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine

C13H16N4S — CID 169049294

IUPAC4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine
SMILESCc1ccnc(N2CCC[C@@H]2c2csc(N)n2)c1
InChIInChI=1S/C13H16N4S/c1-9-4-5-15-12(7-9)17-6-2-3-11(17)10-8-18-13(14)16-10/h4-5,7-8,11H,2-3,6H2,1H3,(H2,14,16)/t11-/m1/s1
InChIKeyGWSJVIAYKNTNEC-LLVKDONJSA-N
MW260.37 g/mol
LogP2.77
Rot. Bonds2

About 4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine

4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine (PubChem CID 169049294) has the molecular formula C13H16N4S and a molecular weight of 260.37 g/mol. Its IUPAC name is 4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine
PubChem CID169049294
Molecular FormulaC13H16N4S
Molecular Weight260.37 g/mol
Exact Mass260.11
IUPAC Name4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine
SMILESCc1ccnc(N2CCC[C@@H]2c2csc(N)n2)c1
InChIInChI=1S/C13H16N4S/c1-9-4-5-15-12(7-9)17-6-2-3-11(17)10-8-18-13(14)16-10/h4-5,7-8,11H,2-3,6H2,1H3,(H2,14,16)/t11-/m1/s1
InChIKeyGWSJVIAYKNTNEC-LLVKDONJSA-N
XLogP2.77
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.37
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(2S)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-yl]-1,3-thiazol-2-amine
CID 95829363
tert-butyl N-[6-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-3-pyridinyl]carbamate
CID 169049392
2-[2-(2-bromoethyl)pyrrolidin-1-yl]-4-methylpyridine
CID 130534011
4-[6-[(2S)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]pyrimidin-4-yl]thiomorpholine
CID 100651914
4-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine
CID 115021188
2-[1-(4-methyl-2-pyridinyl)piperidin-2-yl]ethanamine
CID 63766267
4-[1-(3,4-dichlorophenyl)sulfonylpyrrolidin-2-yl]-1,3-thiazol-2-amine
CID 16768930
2-methyl-4-[(2S)-1-(6-methyl-5-nitro-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazole
CID 125138200
4,6-bis[2-(6-methyl-2-pyridinyl)pyrrolidin-1-yl]pyrimidine
CID 133492915
1-(4-methyl-2-pyridinyl)piperidine-2-carbaldehyde
CID 62663428
2-[2-(3-bromopropyl)pyrrolidin-1-yl]-4-methylpyridine
CID 80679655
4-[(2R)-1-(3-bromopyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidin-2-yl]-2-methyl-1,3-thiazole
CID 167992321

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine?
The IUPAC name of 4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine (CID 169049294) is 4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine is Cc1ccnc(N2CCC[C@@H]2c2csc(N)n2)c1.
What is the InChIKey of 4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine?
The InChIKey is GWSJVIAYKNTNEC-LLVKDONJSA-N. The full InChI is InChI=1S/C13H16N4S/c1-9-4-5-15-12(7-9)17-6-2-3-11(17)10-8-18-13(14)16-10/h4-5,7-8,11H,2-3,6H2,1H3,(H2,14,16)/t11-/m1/s1.
What are the key properties of 4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine?
4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine has a molecular weight of 260.37 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-1-(4-methyl-2-pyridinyl)pyrrolidin-2-yl]-1,3-thiazol-2-amine is sourced from PubChem (CID 169049294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).