1-cyclopropyl-1-quinolin-3-ylpropan-1-ol

C15H17NO — CID 64918922

IUPAC1-cyclopropyl-1-quinolin-3-ylpropan-1-ol
SMILESCCC(O)(c1cnc2ccccc2c1)C1CC1
InChIInChI=1S/C15H17NO/c1-2-15(17,12-7-8-12)13-9-11-5-3-4-6-14(11)16-10-13/h3-6,9-10,12,17H,2,7-8H2,1H3
InChIKeyQUELAXTZAVPNGB-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.24
Rot. Bonds3

About 1-cyclopropyl-1-quinolin-3-ylpropan-1-ol

1-cyclopropyl-1-quinolin-3-ylpropan-1-ol (PubChem CID 64918922) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 1-cyclopropyl-1-quinolin-3-ylpropan-1-ol.

Molecular Properties

Compound Name1-cyclopropyl-1-quinolin-3-ylpropan-1-ol
PubChem CID64918922
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name1-cyclopropyl-1-quinolin-3-ylpropan-1-ol
SMILESCCC(O)(c1cnc2ccccc2c1)C1CC1
InChIInChI=1S/C15H17NO/c1-2-15(17,12-7-8-12)13-9-11-5-3-4-6-14(11)16-10-13/h3-6,9-10,12,17H,2,7-8H2,1H3
InChIKeyQUELAXTZAVPNGB-UHFFFAOYSA-N
XLogP3.24
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-quinolin-3-ylpropan-1-ol?
The IUPAC name of 1-cyclopropyl-1-quinolin-3-ylpropan-1-ol (CID 64918922) is 1-cyclopropyl-1-quinolin-3-ylpropan-1-ol.
What is the SMILES notation for 1-cyclopropyl-1-quinolin-3-ylpropan-1-ol?
The canonical SMILES for 1-cyclopropyl-1-quinolin-3-ylpropan-1-ol is CCC(O)(c1cnc2ccccc2c1)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-quinolin-3-ylpropan-1-ol?
The InChIKey is QUELAXTZAVPNGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-2-15(17,12-7-8-12)13-9-11-5-3-4-6-14(11)16-10-13/h3-6,9-10,12,17H,2,7-8H2,1H3.
What are the key properties of 1-cyclopropyl-1-quinolin-3-ylpropan-1-ol?
1-cyclopropyl-1-quinolin-3-ylpropan-1-ol has a molecular weight of 227.31 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-quinolin-3-ylpropan-1-ol is sourced from PubChem (CID 64918922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).