[(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol

C13H13NO — CID 99996452

IUPAC[(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol
SMILESOC[C@@H]1Cc2cc3ccccc3nc2C1
InChIInChI=1S/C13H13NO/c15-8-9-5-11-7-10-3-1-2-4-12(10)14-13(11)6-9/h1-4,7,9,15H,5-6,8H2/t9-/m1/s1
InChIKeyJINHQGDMTCXPHB-SECBINFHSA-N
MW199.25 g/mol
LogP1.94
Rot. Bonds1

About [(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol

[(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol (PubChem CID 99996452) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is [(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol
PubChem CID99996452
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC Name[(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol
SMILESOC[C@@H]1Cc2cc3ccccc3nc2C1
InChIInChI=1S/C13H13NO/c15-8-9-5-11-7-10-3-1-2-4-12(10)14-13(11)6-9/h1-4,7,9,15H,5-6,8H2/t9-/m1/s1
InChIKeyJINHQGDMTCXPHB-SECBINFHSA-N
XLogP1.94
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol?
The IUPAC name of [(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol (CID 99996452) is [(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol.
What is the SMILES notation for [(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol?
The canonical SMILES for [(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol is OC[C@@H]1Cc2cc3ccccc3nc2C1.
What is the InChIKey of [(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol?
The InChIKey is JINHQGDMTCXPHB-SECBINFHSA-N. The full InChI is InChI=1S/C13H13NO/c15-8-9-5-11-7-10-3-1-2-4-12(10)14-13(11)6-9/h1-4,7,9,15H,5-6,8H2/t9-/m1/s1.
What are the key properties of [(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol?
[(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol has a molecular weight of 199.25 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2,3-dihydro-1H-cyclopenta[b]quinolin-2-yl]methanol is sourced from PubChem (CID 99996452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).