2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine

C19H26N6O — CID 110115987

IUPAC2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine
SMILESCc1cc(C2CN(Cc3ccnc(N4CCCC4)n3)CCO2)nc(C)n1
InChIInChI=1S/C19H26N6O/c1-14-11-17(22-15(2)21-14)18-13-24(9-10-26-18)12-16-5-6-20-19(23-16)25-7-3-4-8-25/h5-6,11,18H,3-4,7-10,12-13H2,1-2H3
InChIKeyHWKHEDFBWRIQPD-UHFFFAOYSA-N
MW354.46 g/mol
LogP2.06
Rot. Bonds4

About 2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine

2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine (PubChem CID 110115987) has the molecular formula C19H26N6O and a molecular weight of 354.46 g/mol. Its IUPAC name is 2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine.

Molecular Properties

Compound Name2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine
PubChem CID110115987
Molecular FormulaC19H26N6O
Molecular Weight354.46 g/mol
Exact Mass354.22
IUPAC Name2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine
SMILESCc1cc(C2CN(Cc3ccnc(N4CCCC4)n3)CCO2)nc(C)n1
InChIInChI=1S/C19H26N6O/c1-14-11-17(22-15(2)21-14)18-13-24(9-10-26-18)12-16-5-6-20-19(23-16)25-7-3-4-8-25/h5-6,11,18H,3-4,7-10,12-13H2,1-2H3
InChIKeyHWKHEDFBWRIQPD-UHFFFAOYSA-N
XLogP2.06
TPSA67.27 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.46
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine with MolForge

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Related Compounds

(2R)-2-(5-methyl-1H-imidazol-2-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine
CID 124960812
N-methyl-6-[(2R)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholin-2-yl]pyridin-2-amine
CID 125027230
(2S)-2-(5-methyl-1H-imidazol-2-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine
CID 124960811
2-(5-methylpyrazin-2-yl)-4-[(2-methylpyrimidin-4-yl)methyl]morpholine
CID 110103266
2-(2,6-dimethylpyrimidin-4-yl)-4-(1,3-thiazol-2-ylmethyl)morpholine
CID 110115917
(2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(1H-pyrazol-5-ylmethyl)morpholine
CID 125024565
(2R)-2-(2,6-dimethylpyrimidin-4-yl)-4-(thiophen-3-ylmethyl)morpholine
CID 124953952
2-(2,6-dimethylpyrimidin-4-yl)-4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine
CID 110115918
2-(2,6-dimethylpyrimidin-4-yl)-4-(quinolin-6-ylmethyl)morpholine
CID 110115969
4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(2,6-dimethylpyrimidin-4-yl)morpholine
CID 110115909
2-(2,6-dimethylpyrimidin-4-yl)-4-(4,6-dimethylpyrimidin-2-yl)morpholine
CID 110115953
2-methyl-6-[(2R)-4-(pyridin-2-ylmethyl)morpholin-2-yl]pyridin-4-amine
CID 124991314

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine?
The IUPAC name of 2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine (CID 110115987) is 2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine.
What is the SMILES notation for 2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine?
The canonical SMILES for 2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine is Cc1cc(C2CN(Cc3ccnc(N4CCCC4)n3)CCO2)nc(C)n1.
What is the InChIKey of 2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine?
The InChIKey is HWKHEDFBWRIQPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O/c1-14-11-17(22-15(2)21-14)18-13-24(9-10-26-18)12-16-5-6-20-19(23-16)25-7-3-4-8-25/h5-6,11,18H,3-4,7-10,12-13H2,1-2H3.
What are the key properties of 2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine?
2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine has a molecular weight of 354.46 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylpyrimidin-4-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine is sourced from PubChem (CID 110115987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).