2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol

C12H20N4O — CID 80934405

IUPAC2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol
SMILESCCc1nc(N)cc(NC2CCCCC2O)n1
InChIInChI=1S/C12H20N4O/c1-2-11-15-10(13)7-12(16-11)14-8-5-3-4-6-9(8)17/h7-9,17H,2-6H2,1H3,(H3,13,14,15,16)
InChIKeyBLNSMVUGKMAFOQ-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.34
Rot. Bonds3

About 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol

2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol (PubChem CID 80934405) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol
PubChem CID80934405
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol
SMILESCCc1nc(N)cc(NC2CCCCC2O)n1
InChIInChI=1S/C12H20N4O/c1-2-11-15-10(13)7-12(16-11)14-8-5-3-4-6-9(8)17/h7-9,17H,2-6H2,1H3,(H3,13,14,15,16)
InChIKeyBLNSMVUGKMAFOQ-UHFFFAOYSA-N
XLogP1.34
TPSA84.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol with MolForge

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Related Compounds

2-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 80934612
[2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclopentyl]methanol
CID 104924452
4-N-cyclobutyl-2-ethylpyrimidine-4,6-diamine
CID 80934753
4-N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2-ethylpyrimidine-4,6-diamine
CID 80934865
4-N-(cyclopentylmethyl)-2-ethylpyrimidine-4,6-diamine
CID 80933112
4-N-(cyclohexylmethyl)-2-ethylpyrimidine-4,6-diamine
CID 80933363
2-[[2-amino-6-(methylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 80826322
4-N-(2,2-dimethylcyclopropyl)-2-ethylpyrimidine-4,6-diamine
CID 80935033
[2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]cyclohexyl]methanol
CID 106368406
4-N-(3,4-dimethylcyclohexyl)-2-ethylpyrimidine-4,6-diamine
CID 80941485
2-ethyl-6-N-methyl-4-N-(2-methylcyclohexyl)pyrimidine-4,6-diamine
CID 80933606
cis-(1S,2R)-2-[(2-amino-6-chloropyrimidin-4-yl)amino]cyclohexan-1-ol
CID 52840167

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol?
The IUPAC name of 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol (CID 80934405) is 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol is CCc1nc(N)cc(NC2CCCCC2O)n1.
What is the InChIKey of 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol?
The InChIKey is BLNSMVUGKMAFOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-2-11-15-10(13)7-12(16-11)14-8-5-3-4-6-9(8)17/h7-9,17H,2-6H2,1H3,(H3,13,14,15,16).
What are the key properties of 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol?
2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol has a molecular weight of 236.32 g/mol, XLogP of 1.34, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 80934405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).