5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine

C14H24N4O — CID 72919733

IUPAC5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine
SMILESCCc1cnc(NCC(CC)N2CCOCC2)nc1
InChIInChI=1S/C14H24N4O/c1-3-12-9-15-14(16-10-12)17-11-13(4-2)18-5-7-19-8-6-18/h9-10,13H,3-8,11H2,1-2H3,(H,15,16,17)
InChIKeyRKDUVDUWHQGYFA-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.56
Rot. Bonds6

About 5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine

5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine (PubChem CID 72919733) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine
PubChem CID72919733
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine
SMILESCCc1cnc(NCC(CC)N2CCOCC2)nc1
InChIInChI=1S/C14H24N4O/c1-3-12-9-15-14(16-10-12)17-11-13(4-2)18-5-7-19-8-6-18/h9-10,13H,3-8,11H2,1-2H3,(H,15,16,17)
InChIKeyRKDUVDUWHQGYFA-UHFFFAOYSA-N
XLogP1.56
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine?
The IUPAC name of 5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine (CID 72919733) is 5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine.
What is the SMILES notation for 5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine?
The canonical SMILES for 5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine is CCc1cnc(NCC(CC)N2CCOCC2)nc1.
What is the InChIKey of 5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine?
The InChIKey is RKDUVDUWHQGYFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-12-9-15-14(16-10-12)17-11-13(4-2)18-5-7-19-8-6-18/h9-10,13H,3-8,11H2,1-2H3,(H,15,16,17).
What are the key properties of 5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine?
5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine has a molecular weight of 264.37 g/mol, XLogP of 1.56, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine is sourced from PubChem (CID 72919733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).