(1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone

C15H21N3O2 — CID 130179826

IUPAC(1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone
SMILESCC1=C(C(=O)N2CCOC[C@@H]2C)N2C=CC=CC2N1C
InChIInChI=1S/C15H21N3O2/c1-11-10-20-9-8-17(11)15(19)14-12(2)16(3)13-6-4-5-7-18(13)14/h4-7,11,13H,8-10H2,1-3H3/t11-,13?/m0/s1
InChIKeyDXLWHGAJQOXHGH-AMGKYWFPSA-N
MW275.35 g/mol
LogP1.12
Rot. Bonds1

About (1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone

(1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone (PubChem CID 130179826) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is (1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name(1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone
PubChem CID130179826
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name(1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone
SMILESCC1=C(C(=O)N2CCOC[C@@H]2C)N2C=CC=CC2N1C
InChIInChI=1S/C15H21N3O2/c1-11-10-20-9-8-17(11)15(19)14-12(2)16(3)13-6-4-5-7-18(13)14/h4-7,11,13H,8-10H2,1-3H3/t11-,13?/m0/s1
InChIKeyDXLWHGAJQOXHGH-AMGKYWFPSA-N
XLogP1.12
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone?
The IUPAC name of (1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone (CID 130179826) is (1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone.
What is the SMILES notation for (1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone?
The canonical SMILES for (1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone is CC1=C(C(=O)N2CCOC[C@@H]2C)N2C=CC=CC2N1C.
What is the InChIKey of (1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone?
The InChIKey is DXLWHGAJQOXHGH-AMGKYWFPSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11-10-20-9-8-17(11)15(19)14-12(2)16(3)13-6-4-5-7-18(13)14/h4-7,11,13H,8-10H2,1-3H3/t11-,13?/m0/s1.
What are the key properties of (1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone?
(1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone has a molecular weight of 275.35 g/mol, XLogP of 1.12, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2-dimethyl-8aH-imidazo[1,2-a]pyridin-3-yl)-[(3S)-3-methylmorpholin-4-yl]methanone is sourced from PubChem (CID 130179826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).