(2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone

C19H23N3O2 — CID 56819953

IUPAC(2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone
SMILESCC1CN(C(=O)c2cncnc2C(C)C)CC(c2ccccc2)O1
InChIInChI=1S/C19H23N3O2/c1-13(2)18-16(9-20-12-21-18)19(23)22-10-14(3)24-17(11-22)15-7-5-4-6-8-15/h4-9,12-14,17H,10-11H2,1-3H3
InChIKeyGANKWFNNQJSMTH-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.20
Rot. Bonds3

About (2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone

(2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone (PubChem CID 56819953) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is (2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone.

Molecular Properties

Compound Name(2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone
PubChem CID56819953
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name(2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone
SMILESCC1CN(C(=O)c2cncnc2C(C)C)CC(c2ccccc2)O1
InChIInChI=1S/C19H23N3O2/c1-13(2)18-16(9-20-12-21-18)19(23)22-10-14(3)24-17(11-22)15-7-5-4-6-8-15/h4-9,12-14,17H,10-11H2,1-3H3
InChIKeyGANKWFNNQJSMTH-UHFFFAOYSA-N
XLogP3.20
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[(2S,6S)-2-methyl-6-phenylmorpholin-4-yl]-(4-propan-2-ylpyrimidin-5-yl)methanone
CID 95583774
[(3R,4R)-3-(aminomethyl)-4-phenylpyrrolidin-1-yl]-(4-propan-2-ylpyrimidin-5-yl)methanone
CID 120745231
[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone
CID 94823256
(2-methyl-6-phenylmorpholin-4-yl)-pyrazin-2-ylmethanone
CID 47914748
(2-methyl-6-phenylmorpholin-4-yl)-phenylmethanone
CID 47914795
[(3R,4R)-3-(aminomethyl)-4-phenylpyrrolidin-1-yl]-(4-propan-2-ylpyrimidin-5-yl)methanone;hydrochloride
CID 120745230
[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-(4-propan-2-ylpyrimidin-5-yl)methanone
CID 95580110
5-[(2S,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]pyridine-2-carboxylic acid
CID 124692496
5-[(2R,6S)-2-methyl-6-phenylmorpholine-4-carbonyl]pyridine-2-carboxylic acid
CID 124694837
5-(2-methyl-6-phenylmorpholine-4-carbonyl)pyridine-2-carboxylic acid
CID 122158408
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

Frequently Asked Questions

What is the IUPAC name of (2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone?
The IUPAC name of (2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone (CID 56819953) is (2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone.
What is the SMILES notation for (2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone?
The canonical SMILES for (2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone is CC1CN(C(=O)c2cncnc2C(C)C)CC(c2ccccc2)O1.
What is the InChIKey of (2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone?
The InChIKey is GANKWFNNQJSMTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-13(2)18-16(9-20-12-21-18)19(23)22-10-14(3)24-17(11-22)15-7-5-4-6-8-15/h4-9,12-14,17H,10-11H2,1-3H3.
What are the key properties of (2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone?
(2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone has a molecular weight of 325.41 g/mol, XLogP of 3.20, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-6-phenylmorpholin-4-yl)-(4-propan-2-ylpyrimidin-5-yl)methanone is sourced from PubChem (CID 56819953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).