(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine

C17H22N6O — CID 129337565

IUPAC(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine
SMILESCCn1cnnc1[C@H]1CN(Cc2cnc3ccc(C)cn23)CCO1
InChIInChI=1S/C17H22N6O/c1-3-22-12-19-20-17(22)15-11-21(6-7-24-15)10-14-8-18-16-5-4-13(2)9-23(14)16/h4-5,8-9,12,15H,3,6-7,10-11H2,1-2H3/t15-/m1/s1
InChIKeyLWXJYCCCBFIILF-OAHLLOKOSA-N
MW326.40 g/mol
LogP1.83
Rot. Bonds4

About (2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine

(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine (PubChem CID 129337565) has the molecular formula C17H22N6O and a molecular weight of 326.40 g/mol. Its IUPAC name is (2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine.

Molecular Properties

Compound Name(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine
PubChem CID129337565
Molecular FormulaC17H22N6O
Molecular Weight326.40 g/mol
Exact Mass326.19
IUPAC Name(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine
SMILESCCn1cnnc1[C@H]1CN(Cc2cnc3ccc(C)cn23)CCO1
InChIInChI=1S/C17H22N6O/c1-3-22-12-19-20-17(22)15-11-21(6-7-24-15)10-14-8-18-16-5-4-13(2)9-23(14)16/h4-5,8-9,12,15H,3,6-7,10-11H2,1-2H3/t15-/m1/s1
InChIKeyLWXJYCCCBFIILF-OAHLLOKOSA-N
XLogP1.83
TPSA60.48 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

(2R)-4-[(7-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-(4-methyl-1,2,4-triazol-3-yl)morpholine
CID 129337844
(2S)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(5-methylfuran-2-yl)methyl]morpholine
CID 129332140
4-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-(4-ethyl-1,2,4-triazol-3-yl)morpholine
CID 129001246
2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(3-methylthiophen-2-yl)methyl]morpholine
CID 128997862
(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-(thiophen-2-ylmethyl)morpholine
CID 129344159
(1R)-2-[(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)morpholin-4-yl]-1-(4-methylphenyl)ethanol
CID 129333633
(2R)-4-[(3-chloro-4-pyridinyl)methyl]-2-(4-ethyl-1,2,4-triazol-3-yl)morpholine
CID 129338594
5-[[(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)morpholin-4-yl]methyl]thiophene-2-carbonitrile
CID 129340117
(2R)-4-(1,3-benzodioxol-4-ylmethyl)-2-(4-ethyl-1,2,4-triazol-3-yl)morpholine
CID 129331530
(2R)-4-[(5-chloro-3-ethyl-1-methylpyrazol-4-yl)methyl]-2-(4-ethyl-1,2,4-triazol-3-yl)morpholine
CID 129332069
(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholine
CID 129340570
4-[2-[(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)morpholin-4-yl]ethoxy]benzonitrile
CID 129332456

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine?
The IUPAC name of (2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine (CID 129337565) is (2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine.
What is the SMILES notation for (2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine?
The canonical SMILES for (2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine is CCn1cnnc1[C@H]1CN(Cc2cnc3ccc(C)cn23)CCO1.
What is the InChIKey of (2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine?
The InChIKey is LWXJYCCCBFIILF-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H22N6O/c1-3-22-12-19-20-17(22)15-11-21(6-7-24-15)10-14-8-18-16-5-4-13(2)9-23(14)16/h4-5,8-9,12,15H,3,6-7,10-11H2,1-2H3/t15-/m1/s1.
What are the key properties of (2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine?
(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine has a molecular weight of 326.40 g/mol, XLogP of 1.83, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(6-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholine is sourced from PubChem (CID 129337565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).