(5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone

C14H19N3O — CID 66585121

IUPAC(5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone
SMILESCC1=CC=CC2NC(C(=O)N3CCCCC3)=CN12
InChIInChI=1S/C14H19N3O/c1-11-6-5-7-13-15-12(10-17(11)13)14(18)16-8-3-2-4-9-16/h5-7,10,13,15H,2-4,8-9H2,1H3
InChIKeyCIQFTSYIKUCIFA-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.55
Rot. Bonds1

About (5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone

(5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone (PubChem CID 66585121) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is (5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone
PubChem CID66585121
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name(5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone
SMILESCC1=CC=CC2NC(C(=O)N3CCCCC3)=CN12
InChIInChI=1S/C14H19N3O/c1-11-6-5-7-13-15-12(10-17(11)13)14(18)16-8-3-2-4-9-16/h5-7,10,13,15H,2-4,8-9H2,1H3
InChIKeyCIQFTSYIKUCIFA-UHFFFAOYSA-N
XLogP1.55
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone?
The IUPAC name of (5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone (CID 66585121) is (5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone is CC1=CC=CC2NC(C(=O)N3CCCCC3)=CN12.
What is the InChIKey of (5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone?
The InChIKey is CIQFTSYIKUCIFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-11-6-5-7-13-15-12(10-17(11)13)14(18)16-8-3-2-4-9-16/h5-7,10,13,15H,2-4,8-9H2,1H3.
What are the key properties of (5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone?
(5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone has a molecular weight of 245.33 g/mol, XLogP of 1.55, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-1,8a-dihydroimidazo[1,2-a]pyridin-2-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 66585121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).