2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol

C11H18N4O — CID 80810039

IUPAC2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol
SMILESCCc1c(N)ncnc1N(CCO)C1CC1
InChIInChI=1S/C11H18N4O/c1-2-9-10(12)13-7-14-11(9)15(5-6-16)8-3-4-8/h7-8,16H,2-6H2,1H3,(H2,12,13,14)
InChIKeyALHXTUXGCXCQGG-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.58
Rot. Bonds5

About 2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol

2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol (PubChem CID 80810039) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol.

Molecular Properties

Compound Name2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol
PubChem CID80810039
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol
SMILESCCc1c(N)ncnc1N(CCO)C1CC1
InChIInChI=1S/C11H18N4O/c1-2-9-10(12)13-7-14-11(9)15(5-6-16)8-3-4-8/h7-8,16H,2-6H2,1H3,(H2,12,13,14)
InChIKeyALHXTUXGCXCQGG-UHFFFAOYSA-N
XLogP0.58
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(6-amino-5-ethylpyrimidin-4-yl)-cyclobutylamino]propan-1-ol
CID 102875507
3-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]propanenitrile
CID 80811362
2-[(6-chloro-5-ethylpyrimidin-4-yl)-cyclobutylamino]ethanol
CID 102865911
4-N-cyclopentyl-5-ethyl-4-N-(3-methylbutyl)pyrimidine-4,6-diamine
CID 80854897
4-N-cyclopropyl-4-N,5-dipropylpyrimidine-4,6-diamine
CID 80774677
2-[(6-amino-5-ethylpyrimidin-4-yl)-propan-2-ylamino]ethanol
CID 80811308
2-[cyclopentyl-(6-hydrazinyl-5-propylpyrimidin-4-yl)amino]ethanol
CID 80904987
4-N-butyl-4-N-cyclopropyl-5-methylpyrimidine-4,6-diamine
CID 80799335
2-[(5-amino-6-chloropyrimidin-4-yl)-cyclobutylamino]ethanol
CID 102859630
4-N-cyclopropyl-4-N-methyl-5-propylpyrimidine-4,6-diamine
CID 80774560
2-[cyclopropyl-[5-propan-2-yl-6-(propylamino)pyrimidin-4-yl]amino]ethanol
CID 80811423
4-N-cyclopropyl-4-N,5-diethyl-6-N-methylpyrimidine-4,6-diamine
CID 80774359

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol?
The IUPAC name of 2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol (CID 80810039) is 2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol.
What is the SMILES notation for 2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol?
The canonical SMILES for 2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol is CCc1c(N)ncnc1N(CCO)C1CC1.
What is the InChIKey of 2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol?
The InChIKey is ALHXTUXGCXCQGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-2-9-10(12)13-7-14-11(9)15(5-6-16)8-3-4-8/h7-8,16H,2-6H2,1H3,(H2,12,13,14).
What are the key properties of 2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol?
2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol has a molecular weight of 222.29 g/mol, XLogP of 0.58, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-5-ethylpyrimidin-4-yl)-cyclopropylamino]ethanol is sourced from PubChem (CID 80810039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).