5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine

C15H25N5O — CID 72936189

IUPAC5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine
SMILESCCc1cnc(N)nc1N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C15H25N5O/c1-2-12-11-17-15(16)18-14(12)20-5-3-13(4-6-20)19-7-9-21-10-8-19/h11,13H,2-10H2,1H3,(H2,16,17,18)
InChIKeyAUCXXCFSHSCRGR-UHFFFAOYSA-N
MW291.40 g/mol
LogP0.92
Rot. Bonds3

About 5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine

5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine (PubChem CID 72936189) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is 5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine
PubChem CID72936189
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC Name5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine
SMILESCCc1cnc(N)nc1N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C15H25N5O/c1-2-12-11-17-15(16)18-14(12)20-5-3-13(4-6-20)19-7-9-21-10-8-19/h11,13H,2-10H2,1H3,(H2,16,17,18)
InChIKeyAUCXXCFSHSCRGR-UHFFFAOYSA-N
XLogP0.92
TPSA67.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine?
The IUPAC name of 5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine (CID 72936189) is 5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine.
What is the SMILES notation for 5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine?
The canonical SMILES for 5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine is CCc1cnc(N)nc1N1CCC(N2CCOCC2)CC1.
What is the InChIKey of 5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine?
The InChIKey is AUCXXCFSHSCRGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-2-12-11-17-15(16)18-14(12)20-5-3-13(4-6-20)19-7-9-21-10-8-19/h11,13H,2-10H2,1H3,(H2,16,17,18).
What are the key properties of 5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine?
5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine has a molecular weight of 291.40 g/mol, XLogP of 0.92, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-2-amine is sourced from PubChem (CID 72936189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).