5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine

C13H22N4O — CID 50959308

IUPAC5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
SMILESCCc1cnc(C)nc1NCCN1CCOCC1
InChIInChI=1S/C13H22N4O/c1-3-12-10-15-11(2)16-13(12)14-4-5-17-6-8-18-9-7-17/h10H,3-9H2,1-2H3,(H,14,15,16)
InChIKeyGQBNGMHQOGBTPB-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.09
Rot. Bonds5

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

5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine (PubChem CID 50959308) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
PubChem CID50959308
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
SMILESCCc1cnc(C)nc1NCCN1CCOCC1
InChIInChI=1S/C13H22N4O/c1-3-12-10-15-11(2)16-13(12)14-4-5-17-6-8-18-9-7-17/h10H,3-9H2,1-2H3,(H,14,15,16)
InChIKeyGQBNGMHQOGBTPB-UHFFFAOYSA-N
XLogP1.09
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine?
The IUPAC name of 5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine (CID 50959308) is 5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine?
The canonical SMILES for 5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine is CCc1cnc(C)nc1NCCN1CCOCC1.
What is the InChIKey of 5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine?
The InChIKey is GQBNGMHQOGBTPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-3-12-10-15-11(2)16-13(12)14-4-5-17-6-8-18-9-7-17/h10H,3-9H2,1-2H3,(H,14,15,16).
What are the key properties of 5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine?
5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine has a molecular weight of 250.35 g/mol, XLogP of 1.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine is sourced from PubChem (CID 50959308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).