1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol

C15H18N2O — CID 63298862

IUPAC1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol
SMILESOC(CNCc1ccc2ccccc2n1)C1CC1
InChIInChI=1S/C15H18N2O/c18-15(12-5-6-12)10-16-9-13-8-7-11-3-1-2-4-14(11)17-13/h1-4,7-8,12,15-16,18H,5-6,9-10H2
InChIKeyXKNHSCLLTQXNNI-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.10
Rot. Bonds5

About 1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol

1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol (PubChem CID 63298862) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol
PubChem CID63298862
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol
SMILESOC(CNCc1ccc2ccccc2n1)C1CC1
InChIInChI=1S/C15H18N2O/c18-15(12-5-6-12)10-16-9-13-8-7-11-3-1-2-4-14(11)17-13/h1-4,7-8,12,15-16,18H,5-6,9-10H2
InChIKeyXKNHSCLLTQXNNI-UHFFFAOYSA-N
XLogP2.10
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol?
The IUPAC name of 1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol (CID 63298862) is 1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol.
What is the SMILES notation for 1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol?
The canonical SMILES for 1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol is OC(CNCc1ccc2ccccc2n1)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol?
The InChIKey is XKNHSCLLTQXNNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c18-15(12-5-6-12)10-16-9-13-8-7-11-3-1-2-4-14(11)17-13/h1-4,7-8,12,15-16,18H,5-6,9-10H2.
What are the key properties of 1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol?
1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol has a molecular weight of 242.32 g/mol, XLogP of 2.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(quinolin-2-ylmethylamino)ethanol is sourced from PubChem (CID 63298862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).