2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol

C14H20N2O — CID 66714428

IUPAC2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol
SMILESCc1cc(N2CCCC2)c2c(n1)C(O)CCC2
InChIInChI=1S/C14H20N2O/c1-10-9-12(16-7-2-3-8-16)11-5-4-6-13(17)14(11)15-10/h9,13,17H,2-8H2,1H3
InChIKeyHCPDERWOHRVJKC-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.36
Rot. Bonds1

About 2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol

2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol (PubChem CID 66714428) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol.

Molecular Properties

Compound Name2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol
PubChem CID66714428
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol
SMILESCc1cc(N2CCCC2)c2c(n1)C(O)CCC2
InChIInChI=1S/C14H20N2O/c1-10-9-12(16-7-2-3-8-16)11-5-4-6-13(17)14(11)15-10/h9,13,17H,2-8H2,1H3
InChIKeyHCPDERWOHRVJKC-UHFFFAOYSA-N
XLogP2.36
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol?
The IUPAC name of 2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol (CID 66714428) is 2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol.
What is the SMILES notation for 2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol?
The canonical SMILES for 2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol is Cc1cc(N2CCCC2)c2c(n1)C(O)CCC2.
What is the InChIKey of 2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol?
The InChIKey is HCPDERWOHRVJKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10-9-12(16-7-2-3-8-16)11-5-4-6-13(17)14(11)15-10/h9,13,17H,2-8H2,1H3.
What are the key properties of 2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol?
2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol has a molecular weight of 232.33 g/mol, XLogP of 2.36, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinolin-8-ol is sourced from PubChem (CID 66714428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).