propan-1-ol;quinoline

C12H15NO — CID 160910097

IUPACpropan-1-ol;quinoline
SMILESCCCO.c1ccc2ncccc2c1
InChIInChI=1S/C9H7N.C3H8O/c1-2-6-9-8(4-1)5-3-7-10-9;1-2-3-4/h1-7H;4H,2-3H2,1H3
InChIKeySQQWSQHTQUXHLH-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.62
Rot. Bonds1

About propan-1-ol;quinoline

propan-1-ol;quinoline (PubChem CID 160910097) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is propan-1-ol;quinoline.

Molecular Properties

Compound Namepropan-1-ol;quinoline
PubChem CID160910097
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Namepropan-1-ol;quinoline
SMILESCCCO.c1ccc2ncccc2c1
InChIInChI=1S/C9H7N.C3H8O/c1-2-6-9-8(4-1)5-3-7-10-9;1-2-3-4/h1-7H;4H,2-3H2,1H3
InChIKeySQQWSQHTQUXHLH-UHFFFAOYSA-N
XLogP2.62
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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quinoline
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osmium(2+);quinoline
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quinoline;silver
CID 88761492
CID 175273158
CID 175273158
hydron;quinoline
CID 131854096
platinum(2+);quinoline
CID 50910245
CID 159709187
CID 159709187
propan-2-ol;quinoline
CID 172685699
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CID 174404526
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CID 174523855

Frequently Asked Questions

What is the IUPAC name of propan-1-ol;quinoline?
The IUPAC name of propan-1-ol;quinoline (CID 160910097) is propan-1-ol;quinoline.
What is the SMILES notation for propan-1-ol;quinoline?
The canonical SMILES for propan-1-ol;quinoline is CCCO.c1ccc2ncccc2c1.
What is the InChIKey of propan-1-ol;quinoline?
The InChIKey is SQQWSQHTQUXHLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N.C3H8O/c1-2-6-9-8(4-1)5-3-7-10-9;1-2-3-4/h1-7H;4H,2-3H2,1H3.
What are the key properties of propan-1-ol;quinoline?
propan-1-ol;quinoline has a molecular weight of 189.26 g/mol, XLogP of 2.62, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for propan-1-ol;quinoline is sourced from PubChem (CID 160910097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).