6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine

C13H21FN4O — CID 103880098

IUPAC6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine
SMILESCCc1ncnc(NCC2CN(CC)CCO2)c1F
InChIInChI=1S/C13H21FN4O/c1-3-11-12(14)13(17-9-16-11)15-7-10-8-18(4-2)5-6-19-10/h9-10H,3-8H2,1-2H3,(H,15,16,17)
InChIKeyLECDFPCIXGIDSE-UHFFFAOYSA-N
MW268.34 g/mol
LogP1.31
Rot. Bonds5

About 6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine

6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine (PubChem CID 103880098) has the molecular formula C13H21FN4O and a molecular weight of 268.34 g/mol. Its IUPAC name is 6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine
PubChem CID103880098
Molecular FormulaC13H21FN4O
Molecular Weight268.34 g/mol
Exact Mass268.17
IUPAC Name6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine
SMILESCCc1ncnc(NCC2CN(CC)CCO2)c1F
InChIInChI=1S/C13H21FN4O/c1-3-11-12(14)13(17-9-16-11)15-7-10-8-18(4-2)5-6-19-10/h9-10H,3-8H2,1-2H3,(H,15,16,17)
InChIKeyLECDFPCIXGIDSE-UHFFFAOYSA-N
XLogP1.31
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-ethylmorpholin-2-yl)methyl]-3,4,5-trifluoroaniline
CID 79165761
5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]-3-fluoropyridin-2-amine
CID 115681758
N-[(4-ethylmorpholin-2-yl)methyl]-3,6-dimethylpyrazin-2-amine
CID 104695446
5-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-3-methylpyridin-2-amine
CID 115693777
N-[(4-ethylmorpholin-2-yl)methyl]-5-iodopyrimidin-2-amine
CID 113459925
6-ethyl-5-fluoro-N-[[1-(2-methylpropyl)pyrrolidin-3-yl]methyl]pyrimidin-4-amine
CID 133419771
N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine
CID 114400660
4-chloro-N-[(4-ethylmorpholin-2-yl)methyl]-1,2,5-thiadiazol-3-amine
CID 114400988
N-[(4-ethylmorpholin-2-yl)methyl]-1-methylimidazol-2-amine
CID 114400676
5-bromo-4-[(4-ethylmorpholin-2-yl)methylamino]-1H-pyrimidin-6-one
CID 136958124
2-[(4-ethylmorpholin-2-yl)methylamino]pyridine-3-carboxamide
CID 115619041
N-[(4-ethylmorpholin-2-yl)methyl]-3-fluoroaniline
CID 79166710

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine?
The IUPAC name of 6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine (CID 103880098) is 6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine?
The canonical SMILES for 6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine is CCc1ncnc(NCC2CN(CC)CCO2)c1F.
What is the InChIKey of 6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine?
The InChIKey is LECDFPCIXGIDSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21FN4O/c1-3-11-12(14)13(17-9-16-11)15-7-10-8-18(4-2)5-6-19-10/h9-10H,3-8H2,1-2H3,(H,15,16,17).
What are the key properties of 6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine?
6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine has a molecular weight of 268.34 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluoropyrimidin-4-amine is sourced from PubChem (CID 103880098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).