(2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone

C19H18ClN3O2 — CID 95147885

IUPAC(2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone
SMILESC[C@@H]1CN(C(=O)c2c(Cl)nc3ccccn23)C[C@H](c2ccccc2)O1
InChIInChI=1S/C19H18ClN3O2/c1-13-11-22(12-15(25-13)14-7-3-2-4-8-14)19(24)17-18(20)21-16-9-5-6-10-23(16)17/h2-10,13,15H,11-12H2,1H3/t13-,15-/m1/s1
InChIKeyZGAPZPXKVWXSJY-UKRRQHHQSA-N
MW355.83 g/mol
LogP3.59
Rot. Bonds2

About (2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone

(2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone (PubChem CID 95147885) has the molecular formula C19H18ClN3O2 and a molecular weight of 355.83 g/mol. Its IUPAC name is (2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name(2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone
PubChem CID95147885
Molecular FormulaC19H18ClN3O2
Molecular Weight355.83 g/mol
Exact Mass355.11
IUPAC Name(2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone
SMILESC[C@@H]1CN(C(=O)c2c(Cl)nc3ccccn23)C[C@H](c2ccccc2)O1
InChIInChI=1S/C19H18ClN3O2/c1-13-11-22(12-15(25-13)14-7-3-2-4-8-14)19(24)17-18(20)21-16-9-5-6-10-23(16)17/h2-10,13,15H,11-12H2,1H3/t13-,15-/m1/s1
InChIKeyZGAPZPXKVWXSJY-UKRRQHHQSA-N
XLogP3.59
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.83
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methyl-6-phenylmorpholin-4-yl)-phenylmethanone
CID 47914795
1H-indazol-7-yl-[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]methanone
CID 95215460
(2-methyl-6-phenylmorpholin-4-yl)-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)methanone
CID 47914996
(2-methyl-6-phenylmorpholin-4-yl)-pyrazin-2-ylmethanone
CID 47914748
[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone
CID 94823256
5-[(2R,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]pyridine-2-carboxylic acid
CID 124694837
3-[(2R,6R)-2-methyl-6-phenylmorpholine-4-carbonyl]-1H-pyridazin-6-one
CID 94823289
5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]pyridine-2-carboxylic acid
CID 124692496
5-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-2-carboxylic acid
CID 122158408
(2-bromo-4-fluorophenyl)-(2-methyl-6-phenylmorpholin-4-yl)methanone
CID 47914309
[(2S,6S)-2-methyl-6-phenylmorpholin-4-yl]-(4-propan-2-ylpyrimidin-5-yl)methanone
CID 95583774
(2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone
CID 56819953

Frequently Asked Questions

What is the IUPAC name of (2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone?
The IUPAC name of (2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone (CID 95147885) is (2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone.
What is the SMILES notation for (2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone?
The canonical SMILES for (2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone is C[C@@H]1CN(C(=O)c2c(Cl)nc3ccccn23)C[C@H](c2ccccc2)O1.
What is the InChIKey of (2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone?
The InChIKey is ZGAPZPXKVWXSJY-UKRRQHHQSA-N. The full InChI is InChI=1S/C19H18ClN3O2/c1-13-11-22(12-15(25-13)14-7-3-2-4-8-14)19(24)17-18(20)21-16-9-5-6-10-23(16)17/h2-10,13,15H,11-12H2,1H3/t13-,15-/m1/s1.
What are the key properties of (2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone?
(2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone has a molecular weight of 355.83 g/mol, XLogP of 3.59, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloroimidazo[1,2-a]pyridin-3-yl)-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]methanone is sourced from PubChem (CID 95147885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).