2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol

C14H23N3O2 — CID 131920208

IUPAC2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol
SMILESCOc1ncc(CN(CCO)C2CCCCC2)cn1
InChIInChI=1S/C14H23N3O2/c1-19-14-15-9-12(10-16-14)11-17(7-8-18)13-5-3-2-4-6-13/h9-10,13,18H,2-8,11H2,1H3
InChIKeyFFQJWMIAJNXUHI-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.61
Rot. Bonds6

About 2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol

2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol (PubChem CID 131920208) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol
PubChem CID131920208
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol
SMILESCOc1ncc(CN(CCO)C2CCCCC2)cn1
InChIInChI=1S/C14H23N3O2/c1-19-14-15-9-12(10-16-14)11-17(7-8-18)13-5-3-2-4-6-13/h9-10,13,18H,2-8,11H2,1H3
InChIKeyFFQJWMIAJNXUHI-UHFFFAOYSA-N
XLogP1.61
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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2-[cyclopentyl(pyrazin-2-ylmethyl)amino]ethanol
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2-[cyclopentyl-[(3,4-dimethylphenyl)methyl]amino]ethanol
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2-[(5-bromo-2-methoxyphenyl)methyl-cyclohexylamino]ethanol
CID 60694517
2-[(5-chloro-2-methoxypyrimidin-4-yl)-cyclopentylamino]ethanol
CID 80752339
2-[(5-bromo-2-pyridinyl)methyl-cyclohexylamino]ethanol
CID 113239605
4-[[cyclobutyl(2-hydroxyethyl)amino]methyl]phenol
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CID 103056002

Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol?
The IUPAC name of 2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol (CID 131920208) is 2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol.
What is the SMILES notation for 2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol?
The canonical SMILES for 2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol is COc1ncc(CN(CCO)C2CCCCC2)cn1.
What is the InChIKey of 2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol?
The InChIKey is FFQJWMIAJNXUHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-19-14-15-9-12(10-16-14)11-17(7-8-18)13-5-3-2-4-6-13/h9-10,13,18H,2-8,11H2,1H3.
What are the key properties of 2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol?
2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol has a molecular weight of 265.36 g/mol, XLogP of 1.61, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl-[(2-methoxypyrimidin-5-yl)methyl]amino]ethanol is sourced from PubChem (CID 131920208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).