4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine

C20H32N4O — CID 133338682

IUPAC4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine
SMILESCC1CN(CCC2CCN(c3ccnc(C4CC4)n3)CC2)CC(C)O1
InChIInChI=1S/C20H32N4O/c1-15-13-23(14-16(2)25-15)10-6-17-7-11-24(12-8-17)19-5-9-21-20(22-19)18-3-4-18/h5,9,15-18H,3-4,6-8,10-14H2,1-2H3
InChIKeyZCOGWCYQUCSRTO-UHFFFAOYSA-N
MW344.50 g/mol
LogP3.07
Rot. Bonds5

About 4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine

4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine (PubChem CID 133338682) has the molecular formula C20H32N4O and a molecular weight of 344.50 g/mol. Its IUPAC name is 4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine.

Molecular Properties

Compound Name4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine
PubChem CID133338682
Molecular FormulaC20H32N4O
Molecular Weight344.50 g/mol
Exact Mass344.26
IUPAC Name4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine
SMILESCC1CN(CCC2CCN(c3ccnc(C4CC4)n3)CC2)CC(C)O1
InChIInChI=1S/C20H32N4O/c1-15-13-23(14-16(2)25-15)10-6-17-7-11-24(12-8-17)19-5-9-21-20(22-19)18-3-4-18/h5,9,15-18H,3-4,6-8,10-14H2,1-2H3
InChIKeyZCOGWCYQUCSRTO-UHFFFAOYSA-N
XLogP3.07
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.50
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-cyclopropylpyrimidin-4-yl)-2,6-dimethylmorpholine
CID 171704070
1-[6-[4-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]piperidin-1-yl]-3-pyridinyl]ethanone
CID 124615419
(2R,6R)-4-[2-[1-(5-fluoropyrimidin-2-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine
CID 124890056
4-[2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine
CID 133338581
4-(azetidin-1-yl)-2-cyclopropylpyrimidine
CID 131087729
2,6-dimethyl-4-[2-[1-[2-pyridin-2-yl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl]ethyl]morpholine
CID 133338567
5-[4-[2-(2,6-dimethylmorpholin-4-yl)ethyl]piperidin-1-yl]pyridine-2-carbonitrile
CID 133338678
2-cyclopropyl-4-(4-ethoxypiperidin-1-yl)pyrimidine
CID 133298308
4-[2-[1-(1,3-benzothiazol-2-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine
CID 133338553
2-cyclopropyl-4-[4-[(3-methyl-4-pyridinyl)oxymethyl]piperidin-1-yl]pyrimidine
CID 155800048
tert-butyl N-[[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]methyl]carbamate
CID 133300314
3-[4-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]ethyl]piperidin-1-yl]-1-ethylpyrazin-2-one
CID 124515157

Frequently Asked Questions

What is the IUPAC name of 4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine?
The IUPAC name of 4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine (CID 133338682) is 4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine.
What is the SMILES notation for 4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine?
The canonical SMILES for 4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine is CC1CN(CCC2CCN(c3ccnc(C4CC4)n3)CC2)CC(C)O1.
What is the InChIKey of 4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine?
The InChIKey is ZCOGWCYQUCSRTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N4O/c1-15-13-23(14-16(2)25-15)10-6-17-7-11-24(12-8-17)19-5-9-21-20(22-19)18-3-4-18/h5,9,15-18H,3-4,6-8,10-14H2,1-2H3.
What are the key properties of 4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine?
4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine has a molecular weight of 344.50 g/mol, XLogP of 3.07, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]ethyl]-2,6-dimethylmorpholine is sourced from PubChem (CID 133338682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).