6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine

C22H27N5O2 — CID 133290389

IUPAC6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine
SMILESCCc1cc(NCC(c2ccc(C)o2)N2CCOCC2)nc(-c2ccccn2)n1
InChIInChI=1S/C22H27N5O2/c1-3-17-14-21(26-22(25-17)18-6-4-5-9-23-18)24-15-19(20-8-7-16(2)29-20)27-10-12-28-13-11-27/h4-9,14,19H,3,10-13,15H2,1-2H3,(H,24,25,26)
InChIKeyUPTXPXDLOHZKQP-UHFFFAOYSA-N
MW393.49 g/mol
LogP3.49
Rot. Bonds7

About 6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine

6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine (PubChem CID 133290389) has the molecular formula C22H27N5O2 and a molecular weight of 393.49 g/mol. Its IUPAC name is 6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine
PubChem CID133290389
Molecular FormulaC22H27N5O2
Molecular Weight393.49 g/mol
Exact Mass393.22
IUPAC Name6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine
SMILESCCc1cc(NCC(c2ccc(C)o2)N2CCOCC2)nc(-c2ccccn2)n1
InChIInChI=1S/C22H27N5O2/c1-3-17-14-21(26-22(25-17)18-6-4-5-9-23-18)24-15-19(20-8-7-16(2)29-20)27-10-12-28-13-11-27/h4-9,14,19H,3,10-13,15H2,1-2H3,(H,24,25,26)
InChIKeyUPTXPXDLOHZKQP-UHFFFAOYSA-N
XLogP3.49
TPSA76.31 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.49
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine with MolForge

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Related Compounds

N-[2-(5-methylthiophen-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-yl-6-(trifluoromethyl)pyrimidin-4-amine
CID 86900419
6-chloro-2-cyclopropyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]pyrimidin-4-amine
CID 133432547
4-N-methyl-2-N-[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]pyrimidine-2,4-diamine
CID 95134762
1-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-pyridin-2-ylurea
CID 51083980
4-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 18164209
N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]pyridine-2-carboxamide
CID 51074519
6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine
CID 62191102
N-[[(7R)-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl]-6-ethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 99805928
6-ethyl-N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-2-pyridin-2-ylpyrimidin-4-amine
CID 133459201
N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-nitropyridin-2-amine
CID 31882355
2-methyl-1-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(2-pyridin-2-ylethyl)guanidine
CID 111193018
6-ethyl-2-methyl-N-[2-(5-methylthiophen-2-yl)-2-morpholin-4-ylethyl]pyrimidin-4-amine
CID 133460472

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine?
The IUPAC name of 6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine (CID 133290389) is 6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine is CCc1cc(NCC(c2ccc(C)o2)N2CCOCC2)nc(-c2ccccn2)n1.
What is the InChIKey of 6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine?
The InChIKey is UPTXPXDLOHZKQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N5O2/c1-3-17-14-21(26-22(25-17)18-6-4-5-9-23-18)24-15-19(20-8-7-16(2)29-20)27-10-12-28-13-11-27/h4-9,14,19H,3,10-13,15H2,1-2H3,(H,24,25,26).
What are the key properties of 6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine?
6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine has a molecular weight of 393.49 g/mol, XLogP of 3.49, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 133290389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).