5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine

C17H19N3S — CID 124972240

IUPAC5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine
SMILESCc1ccsc1CN1CCC[C@@H]1c1cccc2nccn12
InChIInChI=1S/C17H19N3S/c1-13-7-11-21-16(13)12-19-9-3-5-14(19)15-4-2-6-17-18-8-10-20(15)17/h2,4,6-8,10-11,14H,3,5,9,12H2,1H3/t14-/m1/s1
InChIKeyKBQMPLXVMPPNHL-CQSZACIVSA-N
MW297.43 g/mol
LogP4.04
Rot. Bonds3

About 5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine

5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine (PubChem CID 124972240) has the molecular formula C17H19N3S and a molecular weight of 297.43 g/mol. Its IUPAC name is 5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine
PubChem CID124972240
Molecular FormulaC17H19N3S
Molecular Weight297.43 g/mol
Exact Mass297.13
IUPAC Name5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine
SMILESCc1ccsc1CN1CCC[C@@H]1c1cccc2nccn12
InChIInChI=1S/C17H19N3S/c1-13-7-11-21-16(13)12-19-9-3-5-14(19)15-4-2-6-17-18-8-10-20(15)17/h2,4,6-8,10-11,14H,3,5,9,12H2,1H3/t14-/m1/s1
InChIKeyKBQMPLXVMPPNHL-CQSZACIVSA-N
XLogP4.04
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.43
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-[1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]imidazo[1,2-a]pyridine
CID 110100075
4-[(2S)-1-[(3-methylthiophen-2-yl)methyl]piperidin-2-yl]pyrimidine
CID 124971540
[(2R)-2-imidazo[1,2-a]pyridin-5-ylpyrrolidin-1-yl]-(4-methyl-1,3-thiazol-5-yl)methanone
CID 124972218
N-[[2-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-yl]methyl]acetamide
CID 124966489
N-methyl-6-[1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]pyrazin-2-amine
CID 132775734
5-(1-propan-2-ylpiperidin-3-yl)imidazo[1,2-a]pyridine
CID 73439906
N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine
CID 106577983
2-(2-methylimidazol-1-yl)-6-[(2S)-1-(thiophen-2-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95815698
5-methyl-12-[(3-methylthiophen-2-yl)methyl]-4,6,12-triazatricyclo[7.2.1.02,7]dodeca-2,4,6-triene
CID 110226003
4-methyl-5-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,3-thiazole
CID 136543289
6-methyl-5-[[(2S)-2-(6-methyl-2-pyridinyl)pyrrolidin-1-yl]methyl]imidazo[2,1-b][1,3]thiazole
CID 97159618
2-[(3-methylthiophen-2-yl)methyl]-2,9-diazabicyclo[9.3.0]tetradecan-10-one
CID 156611579

Frequently Asked Questions

What is the IUPAC name of 5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine?
The IUPAC name of 5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine (CID 124972240) is 5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine?
The canonical SMILES for 5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine is Cc1ccsc1CN1CCC[C@@H]1c1cccc2nccn12.
What is the InChIKey of 5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine?
The InChIKey is KBQMPLXVMPPNHL-CQSZACIVSA-N. The full InChI is InChI=1S/C17H19N3S/c1-13-7-11-21-16(13)12-19-9-3-5-14(19)15-4-2-6-17-18-8-10-20(15)17/h2,4,6-8,10-11,14H,3,5,9,12H2,1H3/t14-/m1/s1.
What are the key properties of 5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine?
5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine has a molecular weight of 297.43 g/mol, XLogP of 4.04, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2R)-1-[(3-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 124972240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).