(6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

C12H13ClN2S — CID 129462561

IUPAC(6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
SMILESC[C@H]1CCc2nc(-c3ccc(Cl)s3)cn2C1
InChIInChI=1S/C12H13ClN2S/c1-8-2-5-12-14-9(7-15(12)6-8)10-3-4-11(13)16-10/h3-4,7-8H,2,5-6H2,1H3/t8-/m0/s1
InChIKeyHOPLRZVJWLSPCZ-QMMMGPOBSA-N
MW252.77 g/mol
LogP3.85
Rot. Bonds1

About (6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

(6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (PubChem CID 129462561) has the molecular formula C12H13ClN2S and a molecular weight of 252.77 g/mol. Its IUPAC name is (6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name(6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
PubChem CID129462561
Molecular FormulaC12H13ClN2S
Molecular Weight252.77 g/mol
Exact Mass252.05
IUPAC Name(6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
SMILESC[C@H]1CCc2nc(-c3ccc(Cl)s3)cn2C1
InChIInChI=1S/C12H13ClN2S/c1-8-2-5-12-14-9(7-15(12)6-8)10-3-4-11(13)16-10/h3-4,7-8H,2,5-6H2,1H3/t8-/m0/s1
InChIKeyHOPLRZVJWLSPCZ-QMMMGPOBSA-N
XLogP3.85
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.77
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine with MolForge

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Related Compounds

(5S)-2-(5-chlorothiophen-2-yl)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 129462621
(6S)-6-methyl-2-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 129462506
6-methyl-2-pyridin-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 117154346
(6R)-2-(2-fluorophenyl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 129462659
6-methyl-2-[4-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 117154569
2-(3-bromophenyl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 117154544
(8R)-2-(5-chlorothiophen-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
CID 129462756
2-[(2-fluorophenyl)methyl]-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 117154425
2-[(6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol
CID 117154448
7-methyl-2-thiophen-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 117156823
6-methyl-2-(thian-3-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 117154248
N-[2-[5-(6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)-1,2,4-oxadiazol-3-yl]propan-2-yl]acetamide
CID 154769079

Frequently Asked Questions

What is the IUPAC name of (6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The IUPAC name of (6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (CID 129462561) is (6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.
What is the SMILES notation for (6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The canonical SMILES for (6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is C[C@H]1CCc2nc(-c3ccc(Cl)s3)cn2C1.
What is the InChIKey of (6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The InChIKey is HOPLRZVJWLSPCZ-QMMMGPOBSA-N. The full InChI is InChI=1S/C12H13ClN2S/c1-8-2-5-12-14-9(7-15(12)6-8)10-3-4-11(13)16-10/h3-4,7-8H,2,5-6H2,1H3/t8-/m0/s1.
What are the key properties of (6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
(6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine has a molecular weight of 252.77 g/mol, XLogP of 3.85, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-2-(5-chlorothiophen-2-yl)-6-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is sourced from PubChem (CID 129462561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).