2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol

C16H28N4O — CID 80985130

IUPAC2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol
SMILESCCCc1nc(NCC)c(C)c(NC2CCCCC2O)n1
InChIInChI=1S/C16H28N4O/c1-4-8-14-19-15(17-5-2)11(3)16(20-14)18-12-9-6-7-10-13(12)21/h12-13,21H,4-10H2,1-3H3,(H2,17,18,19,20)
InChIKeyVMGQESRASQMBLY-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.88
Rot. Bonds6

About 2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol

2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol (PubChem CID 80985130) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is 2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol
PubChem CID80985130
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol
SMILESCCCc1nc(NCC)c(C)c(NC2CCCCC2O)n1
InChIInChI=1S/C16H28N4O/c1-4-8-14-19-15(17-5-2)11(3)16(20-14)18-12-9-6-7-10-13(12)21/h12-13,21H,4-10H2,1-3H3,(H2,17,18,19,20)
InChIKeyVMGQESRASQMBLY-UHFFFAOYSA-N
XLogP2.88
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)amino]cyclohexan-1-ol
CID 80972579
6-N-ethyl-5-methyl-4-N-(2-methylcyclopentyl)-2-propylpyrimidine-4,6-diamine
CID 80985469
6-N,5-dimethyl-4-N-(2-methylcycloheptyl)-2-propylpyrimidine-4,6-diamine
CID 80992645
6-hydrazinyl-5-methyl-N-(2-methylcyclohexyl)-2-propylpyrimidin-4-amine
CID 81001589
6-N-ethyl-5-methyl-4-N-(3-methylcyclopentyl)-2-propylpyrimidine-4,6-diamine
CID 114542059
6-N,5-dimethyl-4-N-(2-methylcyclopentyl)-2-propylpyrimidine-4,6-diamine
CID 80985581
2-[[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 80826319
4-N-cyclobutyl-5-methyl-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80982309
2-[[5-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 80826428
6-chloro-5-methyl-N-(2-methylcyclohexyl)-2-propylpyrimidin-4-amine
CID 80970319
4-N-(2-cyclopropylethyl)-6-N-ethyl-5-methyl-2-propylpyrimidine-4,6-diamine
CID 80992927
4-N-cyclopentyl-6-N-ethyl-4-N,5-dimethyl-2-propylpyrimidine-4,6-diamine
CID 80993281

Frequently Asked Questions

What is the IUPAC name of 2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol?
The IUPAC name of 2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol (CID 80985130) is 2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol?
The canonical SMILES for 2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol is CCCc1nc(NCC)c(C)c(NC2CCCCC2O)n1.
What is the InChIKey of 2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol?
The InChIKey is VMGQESRASQMBLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-4-8-14-19-15(17-5-2)11(3)16(20-14)18-12-9-6-7-10-13(12)21/h12-13,21H,4-10H2,1-3H3,(H2,17,18,19,20).
What are the key properties of 2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol?
2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol has a molecular weight of 292.43 g/mol, XLogP of 2.88, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]cyclohexan-1-ol is sourced from PubChem (CID 80985130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).