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

C11H17N3O2 — CID 126848087

IUPAC2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
SMILESOCCN(CCO)c1cc(C2CC2)ncn1
InChIInChI=1S/C11H17N3O2/c15-5-3-14(4-6-16)11-7-10(9-1-2-9)12-8-13-11/h7-9,15-16H,1-6H2
InChIKeyBNNUQSOTGRTCOE-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.14
Rot. Bonds6

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

2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol (PubChem CID 126848087) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol.

Molecular Properties

Compound Name2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
PubChem CID126848087
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
SMILESOCCN(CCO)c1cc(C2CC2)ncn1
InChIInChI=1S/C11H17N3O2/c15-5-3-14(4-6-16)11-7-10(9-1-2-9)12-8-13-11/h7-9,15-16H,1-6H2
InChIKeyBNNUQSOTGRTCOE-UHFFFAOYSA-N
XLogP0.14
TPSA69.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol?
The IUPAC name of 2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol (CID 126848087) is 2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol.
What is the SMILES notation for 2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol?
The canonical SMILES for 2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol is OCCN(CCO)c1cc(C2CC2)ncn1.
What is the InChIKey of 2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol?
The InChIKey is BNNUQSOTGRTCOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c15-5-3-14(4-6-16)11-7-10(9-1-2-9)12-8-13-11/h7-9,15-16H,1-6H2.
What are the key properties of 2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol?
2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol has a molecular weight of 223.28 g/mol, XLogP of 0.14, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-cyclopropylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol is sourced from PubChem (CID 126848087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).