N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine

C14H24N4O — CID 50977646

IUPACN-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine
SMILESCCc1cc(NC(C)(C)C)nc(N2CCOCC2)n1
InChIInChI=1S/C14H24N4O/c1-5-11-10-12(17-14(2,3)4)16-13(15-11)18-6-8-19-9-7-18/h10H,5-9H2,1-4H3,(H,15,16,17)
InChIKeyUPASRERPVXKTFM-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.09
Rot. Bonds3

About N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine

N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine (PubChem CID 50977646) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine
PubChem CID50977646
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine
SMILESCCc1cc(NC(C)(C)C)nc(N2CCOCC2)n1
InChIInChI=1S/C14H24N4O/c1-5-11-10-12(17-14(2,3)4)16-13(15-11)18-6-8-19-9-7-18/h10H,5-9H2,1-4H3,(H,15,16,17)
InChIKeyUPASRERPVXKTFM-UHFFFAOYSA-N
XLogP2.09
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine?
The IUPAC name of N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine (CID 50977646) is N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine.
What is the SMILES notation for N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine?
The canonical SMILES for N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine is CCc1cc(NC(C)(C)C)nc(N2CCOCC2)n1.
What is the InChIKey of N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine?
The InChIKey is UPASRERPVXKTFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-5-11-10-12(17-14(2,3)4)16-13(15-11)18-6-8-19-9-7-18/h10H,5-9H2,1-4H3,(H,15,16,17).
What are the key properties of N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine?
N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine has a molecular weight of 264.37 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 50977646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).