3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol

C15H20N4O2 — CID 106198815

IUPAC3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol
SMILESCNc1cc(NC(CO)COC)nc(-c2ccccc2)n1
InChIInChI=1S/C15H20N4O2/c1-16-13-8-14(17-12(9-20)10-21-2)19-15(18-13)11-6-4-3-5-7-11/h3-8,12,20H,9-10H2,1-2H3,(H2,16,17,18,19)
InChIKeyBEKXNDIHAHGXIC-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.60
Rot. Bonds7

About 3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol

3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol (PubChem CID 106198815) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol.

Molecular Properties

Compound Name3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol
PubChem CID106198815
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol
SMILESCNc1cc(NC(CO)COC)nc(-c2ccccc2)n1
InChIInChI=1S/C15H20N4O2/c1-16-13-8-14(17-12(9-20)10-21-2)19-15(18-13)11-6-4-3-5-7-11/h3-8,12,20H,9-10H2,1-2H3,(H2,16,17,18,19)
InChIKeyBEKXNDIHAHGXIC-UHFFFAOYSA-N
XLogP1.60
TPSA79.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propane-1,3-diol
CID 115915673
3-methoxy-2-[[2-(methoxymethyl)-6-(methylamino)pyrimidin-4-yl]amino]propan-1-ol
CID 114157112
2-[(6-amino-2-phenylpyrimidin-4-yl)amino]propane-1,3-diol
CID 112559838
4-N-(1-methoxypropan-2-yl)-4-N,6-N-dimethyl-2-phenylpyrimidine-4,6-diamine
CID 115915445
4-methoxy-3-[[6-(methylamino)-2-methylsulfanylpyrimidin-4-yl]amino]butan-1-ol
CID 114152250
N-methyl-2,6-diphenylpyrimidin-4-amine
CID 4713922
4-N-(1-methoxybutan-2-yl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80959645
3-methoxy-2-[[2-(methylamino)pyrimidin-4-yl]amino]propan-1-ol
CID 106198786
N-methyl-6-(4-methylpentoxy)-2-phenylpyrimidin-4-amine
CID 115915818
6-N-(2-methoxyethyl)-2-phenyl-4-N-(1-phenylethyl)pyrimidine-4,6-diamine
CID 112880243
N-methyl-2-phenyl-6-propan-2-yloxypyrimidin-4-amine
CID 112559886
3-methoxy-2-[(6-methoxy-2-pyridinyl)amino]propan-1-ol
CID 106186402

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol?
The IUPAC name of 3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol (CID 106198815) is 3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol.
What is the SMILES notation for 3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol?
The canonical SMILES for 3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol is CNc1cc(NC(CO)COC)nc(-c2ccccc2)n1.
What is the InChIKey of 3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol?
The InChIKey is BEKXNDIHAHGXIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-16-13-8-14(17-12(9-20)10-21-2)19-15(18-13)11-6-4-3-5-7-11/h3-8,12,20H,9-10H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol?
3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol has a molecular weight of 288.35 g/mol, XLogP of 1.60, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-[[6-(methylamino)-2-phenylpyrimidin-4-yl]amino]propan-1-ol is sourced from PubChem (CID 106198815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).