2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol

C15H25N3O — CID 66146131

IUPAC2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol
SMILESOCCN(Cc1cncn1C1CC1)C1CCCCC1
InChIInChI=1S/C15H25N3O/c19-9-8-17(13-4-2-1-3-5-13)11-15-10-16-12-18(15)14-6-7-14/h10,12-14,19H,1-9,11H2
InChIKeyXWXMAJBRQXRYIM-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.35
Rot. Bonds6

About 2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol

2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol (PubChem CID 66146131) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol
PubChem CID66146131
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol
SMILESOCCN(Cc1cncn1C1CC1)C1CCCCC1
InChIInChI=1S/C15H25N3O/c19-9-8-17(13-4-2-1-3-5-13)11-15-10-16-12-18(15)14-6-7-14/h10,12-14,19H,1-9,11H2
InChIKeyXWXMAJBRQXRYIM-UHFFFAOYSA-N
XLogP2.35
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol?
The IUPAC name of 2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol (CID 66146131) is 2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol.
What is the SMILES notation for 2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol?
The canonical SMILES for 2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol is OCCN(Cc1cncn1C1CC1)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol?
The InChIKey is XWXMAJBRQXRYIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c19-9-8-17(13-4-2-1-3-5-13)11-15-10-16-12-18(15)14-6-7-14/h10,12-14,19H,1-9,11H2.
What are the key properties of 2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol?
2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol has a molecular weight of 263.38 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl-[(3-cyclopropylimidazol-4-yl)methyl]amino]ethanol is sourced from PubChem (CID 66146131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).