4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine

C15H19N5O2 — CID 19137683

IUPAC4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine
SMILESCOc1ccccc1Nc1ncnc(N2CCOCC2)c1N
InChIInChI=1S/C15H19N5O2/c1-21-12-5-3-2-4-11(12)19-14-13(16)15(18-10-17-14)20-6-8-22-9-7-20/h2-5,10H,6-9,16H2,1H3,(H,17,18,19)
InChIKeyBPWWEYYDHHWHDQ-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.65
Rot. Bonds4

About 4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine

4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine (PubChem CID 19137683) has the molecular formula C15H19N5O2 and a molecular weight of 301.35 g/mol. Its IUPAC name is 4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine.

Molecular Properties

Compound Name4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine
PubChem CID19137683
Molecular FormulaC15H19N5O2
Molecular Weight301.35 g/mol
Exact Mass301.15
IUPAC Name4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine
SMILESCOc1ccccc1Nc1ncnc(N2CCOCC2)c1N
InChIInChI=1S/C15H19N5O2/c1-21-12-5-3-2-4-11(12)19-14-13(16)15(18-10-17-14)20-6-8-22-9-7-20/h2-5,10H,6-9,16H2,1H3,(H,17,18,19)
InChIKeyBPWWEYYDHHWHDQ-UHFFFAOYSA-N
XLogP1.65
TPSA85.53 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

1-[5-amino-6-(2-methoxyanilino)pyrimidin-4-yl]piperidine-4-carboxylic acid
CID 19148218
4-N-(2-ethoxyphenyl)-6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidine-4,5-diamine
CID 19139028
N'-(5-amino-6-morpholin-4-ylpyrimidin-4-yl)-2-methoxybenzohydrazide
CID 19137718
6-(2,3-dihydroindol-1-yl)-4-N-(2-methoxyphenyl)pyrimidine-4,5-diamine
CID 22543245
N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidin-4-amine
CID 112857120
4-N-(5-chloro-2-methoxyphenyl)-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,5-diamine
CID 22546098
4-N-(2,5-dichlorophenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine
CID 19137671
6-(3,4-dihydro-1H-isoquinolin-2-yl)-4-N-(2-ethoxyphenyl)pyrimidine-4,5-diamine
CID 19147525
4-N-(2,5-dimethoxyphenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidine-4,5-diamine
CID 19142781
4-N-(4-ethoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine
CID 19137693
4-N-cyclopentyl-6-N-(2-methoxyphenyl)pyrimidine-4,5,6-triamine
CID 19148201
5-fluoro-N-(2-methoxyphenyl)-2-morpholin-4-ylpyrimidin-4-amine
CID 786847

Frequently Asked Questions

What is the IUPAC name of 4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine?
The IUPAC name of 4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine (CID 19137683) is 4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine.
What is the SMILES notation for 4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine?
The canonical SMILES for 4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine is COc1ccccc1Nc1ncnc(N2CCOCC2)c1N.
What is the InChIKey of 4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine?
The InChIKey is BPWWEYYDHHWHDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2/c1-21-12-5-3-2-4-11(12)19-14-13(16)15(18-10-17-14)20-6-8-22-9-7-20/h2-5,10H,6-9,16H2,1H3,(H,17,18,19).
What are the key properties of 4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine?
4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine has a molecular weight of 301.35 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-methoxyphenyl)-6-morpholin-4-ylpyrimidine-4,5-diamine is sourced from PubChem (CID 19137683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).