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

C19H21N5S — CID 124957204

IUPAC3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine
SMILESCc1cccnc1Nc1cc([C@H]2CCCN2Cc2cscn2)ccn1
InChIInChI=1S/C19H21N5S/c1-14-4-2-7-21-19(14)23-18-10-15(6-8-20-18)17-5-3-9-24(17)11-16-12-25-13-22-16/h2,4,6-8,10,12-13,17H,3,5,9,11H2,1H3,(H,20,21,23)/t17-/m1/s1
InChIKeyFXEZZSVIHBQDKQ-QGZVFWFLSA-N
MW351.48 g/mol
LogP4.32
Rot. Bonds5

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

3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine (PubChem CID 124957204) has the molecular formula C19H21N5S and a molecular weight of 351.48 g/mol. Its IUPAC name is 3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine.

Molecular Properties

Compound Name3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine
PubChem CID124957204
Molecular FormulaC19H21N5S
Molecular Weight351.48 g/mol
Exact Mass351.15
IUPAC Name3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine
SMILESCc1cccnc1Nc1cc([C@H]2CCCN2Cc2cscn2)ccn1
InChIInChI=1S/C19H21N5S/c1-14-4-2-7-21-19(14)23-18-10-15(6-8-20-18)17-5-3-9-24(17)11-16-12-25-13-22-16/h2,4,6-8,10,12-13,17H,3,5,9,11H2,1H3,(H,20,21,23)/t17-/m1/s1
InChIKeyFXEZZSVIHBQDKQ-QGZVFWFLSA-N
XLogP4.32
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.48
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine with MolForge

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Related Compounds

N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyrimidin-2-amine
CID 124954569
4-[[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]methyl]-1,3-thiazole
CID 95729061
6-methyl-N-pyrimidin-2-yl-2-[1-(1,3-thiazol-4-ylmethyl)piperidin-2-yl]pyrimidin-4-amine
CID 110111594
[(2R)-2-[2-[(3-methyl-2-pyridinyl)amino]-4-pyridinyl]pyrrolidin-1-yl]-(2-methylpyrimidin-4-yl)methanone
CID 125002330
3-methyl-N-[5-[(2R)-1-(quinoxalin-6-ylmethyl)piperidin-2-yl]-2-pyridinyl]pyridin-2-amine
CID 124977775
3-methyl-N-(4-piperidin-3-yl-2-pyridinyl)pyridin-2-amine
CID 175661172
3-methyl-N-(4-pyrrolidin-2-yl-2-pyridinyl)pyridin-2-amine
CID 110095928
3-methyl-N-[4-[(3R)-1-[(3-methylimidazol-4-yl)methyl]piperidin-3-yl]-2-pyridinyl]pyridin-2-amine
CID 124950083
N,N,2-trimethyl-6-[(2S)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]pyrimidin-4-amine
CID 124948743
N-methyl-4-[(2R)-1-(1,3-thiazol-5-ylmethyl)pyrrolidin-2-yl]pyridin-2-amine
CID 124964991
N-[4-[(2S)-1-[(2-methoxypyrimidin-5-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 125004240
3,5-dimethyl-4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-1,2-oxazole
CID 99931192

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine?
The IUPAC name of 3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine (CID 124957204) is 3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine.
What is the SMILES notation for 3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine?
The canonical SMILES for 3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine is Cc1cccnc1Nc1cc([C@H]2CCCN2Cc2cscn2)ccn1.
What is the InChIKey of 3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine?
The InChIKey is FXEZZSVIHBQDKQ-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H21N5S/c1-14-4-2-7-21-19(14)23-18-10-15(6-8-20-18)17-5-3-9-24(17)11-16-12-25-13-22-16/h2,4,6-8,10,12-13,17H,3,5,9,11H2,1H3,(H,20,21,23)/t17-/m1/s1.
What are the key properties of 3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine?
3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine has a molecular weight of 351.48 g/mol, XLogP of 4.32, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[4-[(2R)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]pyridin-2-amine is sourced from PubChem (CID 124957204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).