6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine

C16H20N4O — CID 112857039

IUPAC6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine
SMILESc1ccc(CCNc2cc(N3CCOCC3)ncn2)cc1
InChIInChI=1S/C16H20N4O/c1-2-4-14(5-3-1)6-7-17-15-12-16(19-13-18-15)20-8-10-21-11-9-20/h1-5,12-13H,6-11H2,(H,17,18,19)
InChIKeyDXWWNPGMMBNWOV-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.97
Rot. Bonds5

About 6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine

6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine (PubChem CID 112857039) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine
PubChem CID112857039
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine
SMILESc1ccc(CCNc2cc(N3CCOCC3)ncn2)cc1
InChIInChI=1S/C16H20N4O/c1-2-4-14(5-3-1)6-7-17-15-12-16(19-13-18-15)20-8-10-21-11-9-20/h1-5,12-13H,6-11H2,(H,17,18,19)
InChIKeyDXWWNPGMMBNWOV-UHFFFAOYSA-N
XLogP1.97
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(6-morpholin-4-ylpyrimidin-4-yl)-3-phenylpropanamide
CID 90544169
2-[(6-morpholin-4-ylpyrimidin-4-yl)amino]ethanol
CID 24880632
N-(2-morpholin-4-ylethyl)-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine
CID 112857585
4-[6-[4-(2-phenylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 122282526
4-[2-[(6-pyrrolidin-1-ylpyrimidin-4-yl)amino]ethyl]phenol
CID 154745147
6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine
CID 43724739
4-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-2-amine
CID 112886384
6-morpholin-4-yl-N-pentylpyrimidin-4-amine
CID 112857074
N-[2-(4-fluorophenyl)ethyl]-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-amine
CID 112861382
N-[2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl]-6-morpholin-4-ylpyrimidin-4-amine
CID 122282628
3-(3-chlorophenyl)-N-[2-[(6-morpholin-4-ylpyrimidin-4-yl)amino]ethyl]propanamide
CID 122327995
2-(1,3-dioxoisoindol-2-yl)-N-[2-[(6-morpholin-4-ylpyrimidin-4-yl)amino]ethyl]acetamide
CID 122327950

Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine?
The IUPAC name of 6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine (CID 112857039) is 6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine?
The canonical SMILES for 6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine is c1ccc(CCNc2cc(N3CCOCC3)ncn2)cc1.
What is the InChIKey of 6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine?
The InChIKey is DXWWNPGMMBNWOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-2-4-14(5-3-1)6-7-17-15-12-16(19-13-18-15)20-8-10-21-11-9-20/h1-5,12-13H,6-11H2,(H,17,18,19).
What are the key properties of 6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine?
6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine has a molecular weight of 284.36 g/mol, XLogP of 1.97, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-N-(2-phenylethyl)pyrimidin-4-amine is sourced from PubChem (CID 112857039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).