2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol

C15H19N3O2 — CID 115915860

IUPAC2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol
SMILESCCCNc1cc(OCCO)nc(-c2ccccc2)n1
InChIInChI=1S/C15H19N3O2/c1-2-8-16-13-11-14(20-10-9-19)18-15(17-13)12-6-4-3-5-7-12/h3-7,11,19H,2,8-10H2,1H3,(H,16,17,18)
InChIKeyRSSCYHPEEDADAE-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.34
Rot. Bonds7

About 2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol

2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol (PubChem CID 115915860) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol.

Molecular Properties

Compound Name2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol
PubChem CID115915860
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol
SMILESCCCNc1cc(OCCO)nc(-c2ccccc2)n1
InChIInChI=1S/C15H19N3O2/c1-2-8-16-13-11-14(20-10-9-19)18-15(17-13)12-6-4-3-5-7-12/h3-7,11,19H,2,8-10H2,1H3,(H,16,17,18)
InChIKeyRSSCYHPEEDADAE-UHFFFAOYSA-N
XLogP2.34
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-phenyl-6-prop-2-enoxy-N-propylpyrimidin-4-amine
CID 115915808
6-(2,2-difluoroethoxy)-2-phenyl-N-propylpyrimidin-4-amine
CID 115915961
N-ethyl-6-pentoxy-2-phenylpyrimidin-4-amine
CID 115915870
6-butoxy-N-methyl-2-phenylpyrimidin-4-amine
CID 112559898
N-methyl-6-pentoxy-2-phenylpyrimidin-4-amine
CID 115915871
4-N-pentyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
CID 112879234
6-ethyl-2-phenyl-N-propylpyrimidin-4-amine
CID 62192699
4-N-benzyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
CID 112879191
[2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-yl]hydrazine
CID 115916312
[6-(2-ethoxyethoxy)-2-phenylpyrimidin-4-yl]hydrazine
CID 115916297
2-[[2-phenyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 115915242
4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
CID 112879230

Frequently Asked Questions

What is the IUPAC name of 2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol?
The IUPAC name of 2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol (CID 115915860) is 2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol.
What is the SMILES notation for 2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol?
The canonical SMILES for 2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol is CCCNc1cc(OCCO)nc(-c2ccccc2)n1.
What is the InChIKey of 2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol?
The InChIKey is RSSCYHPEEDADAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-2-8-16-13-11-14(20-10-9-19)18-15(17-13)12-6-4-3-5-7-12/h3-7,11,19H,2,8-10H2,1H3,(H,16,17,18).
What are the key properties of 2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol?
2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol has a molecular weight of 273.34 g/mol, XLogP of 2.34, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-phenyl-6-(propylamino)pyrimidin-4-yl]oxyethanol is sourced from PubChem (CID 115915860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).