2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol

C15H26N4O — CID 80955025

IUPAC2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol
SMILESCCCc1nc(N)cc(N(CCO)C2CCCCC2)n1
InChIInChI=1S/C15H26N4O/c1-2-6-14-17-13(16)11-15(18-14)19(9-10-20)12-7-4-3-5-8-12/h11-12,20H,2-10H2,1H3,(H2,16,17,18)
InChIKeyAIFQGJIDVOFCSQ-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.14
Rot. Bonds6

About 2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol

2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol (PubChem CID 80955025) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol.

Molecular Properties

Compound Name2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol
PubChem CID80955025
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol
SMILESCCCc1nc(N)cc(N(CCO)C2CCCCC2)n1
InChIInChI=1S/C15H26N4O/c1-2-6-14-17-13(16)11-15(18-14)19(9-10-20)12-7-4-3-5-8-12/h11-12,20H,2-10H2,1H3,(H2,16,17,18)
InChIKeyAIFQGJIDVOFCSQ-UHFFFAOYSA-N
XLogP2.14
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol?
The IUPAC name of 2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol (CID 80955025) is 2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol.
What is the SMILES notation for 2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol?
The canonical SMILES for 2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol is CCCc1nc(N)cc(N(CCO)C2CCCCC2)n1.
What is the InChIKey of 2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol?
The InChIKey is AIFQGJIDVOFCSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-2-6-14-17-13(16)11-15(18-14)19(9-10-20)12-7-4-3-5-8-12/h11-12,20H,2-10H2,1H3,(H2,16,17,18).
What are the key properties of 2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol?
2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol has a molecular weight of 278.40 g/mol, XLogP of 2.14, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-2-propylpyrimidin-4-yl)-cyclohexylamino]ethanol is sourced from PubChem (CID 80955025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).