(2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide

C15H19N3OS — CID 95773682

IUPAC(2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide
SMILESCc1cn2c(n1)CC[C@@H](NC(=O)[C@H](C)c1ccsc1)C2
InChIInChI=1S/C15H19N3OS/c1-10-7-18-8-13(3-4-14(18)16-10)17-15(19)11(2)12-5-6-20-9-12/h5-7,9,11,13H,3-4,8H2,1-2H3,(H,17,19)/t11-,13-/m1/s1
InChIKeyBUATUJPJGPLWSQ-DGCLKSJQSA-N
MW289.40 g/mol
LogP2.49
Rot. Bonds3

About (2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide

(2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide (PubChem CID 95773682) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is (2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide.

Molecular Properties

Compound Name(2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide
PubChem CID95773682
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC Name(2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide
SMILESCc1cn2c(n1)CC[C@@H](NC(=O)[C@H](C)c1ccsc1)C2
InChIInChI=1S/C15H19N3OS/c1-10-7-18-8-13(3-4-14(18)16-10)17-15(19)11(2)12-5-6-20-9-12/h5-7,9,11,13H,3-4,8H2,1-2H3,(H,17,19)/t11-,13-/m1/s1
InChIKeyBUATUJPJGPLWSQ-DGCLKSJQSA-N
XLogP2.49
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide
CID 95773681
(2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-2-ylpropanamide
CID 95773674
(2S)-2-methoxy-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 95765991
(2S)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 95765985
(2S)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 95765955
(2S)-2-ethoxy-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 95765907
(2S)-2-methoxy-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-phenylacetamide
CID 95765920
(2R)-2-(2-methoxyethoxy)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 95769272
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-thiophen-2-ylacetamide
CID 86772548
(2S)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-methyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]butanamide
CID 129448698
3-methyl-N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-propan-2-yl-1,2-oxazole-4-carboxamide
CID 86772586
1-(1-benzothiophen-3-yl)-3-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)urea
CID 167763785

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide?
The IUPAC name of (2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide (CID 95773682) is (2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide.
What is the SMILES notation for (2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide?
The canonical SMILES for (2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide is Cc1cn2c(n1)CC[C@@H](NC(=O)[C@H](C)c1ccsc1)C2.
What is the InChIKey of (2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide?
The InChIKey is BUATUJPJGPLWSQ-DGCLKSJQSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-10-7-18-8-13(3-4-14(18)16-10)17-15(19)11(2)12-5-6-20-9-12/h5-7,9,11,13H,3-4,8H2,1-2H3,(H,17,19)/t11-,13-/m1/s1.
What are the key properties of (2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide?
(2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide has a molecular weight of 289.40 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-3-ylpropanamide is sourced from PubChem (CID 95773682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).