2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol

C14H24N4O2 — CID 102631435

IUPAC2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol
SMILESCC(C)Oc1ncnc(N(C)C2CCCCC2O)c1N
InChIInChI=1S/C14H24N4O2/c1-9(2)20-14-12(15)13(16-8-17-14)18(3)10-6-4-5-7-11(10)19/h8-11,19H,4-7,15H2,1-3H3
InChIKeyPRLKYNXVNVXYJO-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.59
Rot. Bonds4

About 2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol

2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol (PubChem CID 102631435) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol
PubChem CID102631435
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol
SMILESCC(C)Oc1ncnc(N(C)C2CCCCC2O)c1N
InChIInChI=1S/C14H24N4O2/c1-9(2)20-14-12(15)13(16-8-17-14)18(3)10-6-4-5-7-11(10)19/h8-11,19H,4-7,15H2,1-3H3
InChIKeyPRLKYNXVNVXYJO-UHFFFAOYSA-N
XLogP1.59
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(5-aminopyrimidin-4-yl)-methylamino]cyclohexan-1-ol
CID 102631354
2-[(6-hydrazinyl-5-methylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol
CID 102640226
2-N-methyl-2-N-(6-propan-2-yloxypyrimidin-4-yl)cyclohexane-1,2-diamine
CID 102639480
2-[methyl(thieno[3,2-d]pyrimidin-4-yl)amino]cyclohexan-1-ol
CID 102635901
4-(2-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine
CID 19140190
2-[[6-(ethylamino)-5-methoxypyrimidin-4-yl]-methylamino]cyclohexan-1-ol
CID 102640153
[1-(5-amino-6-propan-2-yloxypyrimidin-4-yl)azepan-2-yl]methanol
CID 116634054
4-N-(2-ethoxyethyl)-4-N-methyl-6-propan-2-yloxypyrimidine-4,5-diamine
CID 81058356
4-(2-cyclopropylethoxy)-6-propan-2-yloxypyrimidin-5-amine
CID 106199609
4-chloro-6-propan-2-yloxypyrimidin-5-amine
CID 23477591
4-N-(3-cyclopentylpropyl)-6-propan-2-yloxypyrimidine-4,5-diamine
CID 106007220
4-(4-methylpiperidin-1-yl)-6-propan-2-yloxypyrimidin-5-amine
CID 19140358

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol?
The IUPAC name of 2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol (CID 102631435) is 2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol.
What is the SMILES notation for 2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol?
The canonical SMILES for 2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol is CC(C)Oc1ncnc(N(C)C2CCCCC2O)c1N.
What is the InChIKey of 2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol?
The InChIKey is PRLKYNXVNVXYJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-9(2)20-14-12(15)13(16-8-17-14)18(3)10-6-4-5-7-11(10)19/h8-11,19H,4-7,15H2,1-3H3.
What are the key properties of 2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol?
2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol has a molecular weight of 280.37 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-6-propan-2-yloxypyrimidin-4-yl)-methylamino]cyclohexan-1-ol is sourced from PubChem (CID 102631435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).