2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol

C11H20N4O2 — CID 80955354

IUPAC2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
SMILESCCCc1nc(N)cc(N(CCO)CCO)n1
InChIInChI=1S/C11H20N4O2/c1-2-3-10-13-9(12)8-11(14-10)15(4-6-16)5-7-17/h8,16-17H,2-7H2,1H3,(H2,12,13,14)
InChIKeyKLRLRWKJZLETHW-UHFFFAOYSA-N
MW240.31 g/mol
LogP-0.20
Rot. Bonds7

About 2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol

2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol (PubChem CID 80955354) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol.

Molecular Properties

Compound Name2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
PubChem CID80955354
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
SMILESCCCc1nc(N)cc(N(CCO)CCO)n1
InChIInChI=1S/C11H20N4O2/c1-2-3-10-13-9(12)8-11(14-10)15(4-6-16)5-7-17/h8,16-17H,2-7H2,1H3,(H2,12,13,14)
InChIKeyKLRLRWKJZLETHW-UHFFFAOYSA-N
XLogP-0.20
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 5-0.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol?
The IUPAC name of 2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol (CID 80955354) is 2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol.
What is the SMILES notation for 2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol?
The canonical SMILES for 2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol is CCCc1nc(N)cc(N(CCO)CCO)n1.
What is the InChIKey of 2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol?
The InChIKey is KLRLRWKJZLETHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-2-3-10-13-9(12)8-11(14-10)15(4-6-16)5-7-17/h8,16-17H,2-7H2,1H3,(H2,12,13,14).
What are the key properties of 2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol?
2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol has a molecular weight of 240.31 g/mol, XLogP of -0.20, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol is sourced from PubChem (CID 80955354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).