cycloheptyl(quinolin-7-yl)methanol

C17H21NO — CID 81216722

IUPACcycloheptyl(quinolin-7-yl)methanol
SMILESOC(c1ccc2cccnc2c1)C1CCCCCC1
InChIInChI=1S/C17H21NO/c19-17(14-6-3-1-2-4-7-14)15-10-9-13-8-5-11-18-16(13)12-15/h5,8-12,14,17,19H,1-4,6-7H2
InChIKeyRDBZZELRZUALMD-UHFFFAOYSA-N
MW255.36 g/mol
LogP4.24
Rot. Bonds2

About cycloheptyl(quinolin-7-yl)methanol

cycloheptyl(quinolin-7-yl)methanol (PubChem CID 81216722) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is cycloheptyl(quinolin-7-yl)methanol.

Molecular Properties

Compound Namecycloheptyl(quinolin-7-yl)methanol
PubChem CID81216722
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Namecycloheptyl(quinolin-7-yl)methanol
SMILESOC(c1ccc2cccnc2c1)C1CCCCCC1
InChIInChI=1S/C17H21NO/c19-17(14-6-3-1-2-4-7-14)15-10-9-13-8-5-11-18-16(13)12-15/h5,8-12,14,17,19H,1-4,6-7H2
InChIKeyRDBZZELRZUALMD-UHFFFAOYSA-N
XLogP4.24
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

oxan-3-yl(quinolin-7-yl)methanol
CID 81216710
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-quinolin-7-ylmethanol
CID 115997893
(3-methylcyclopentyl)-quinolin-7-ylmethanol
CID 81220222
oxolan-3-yl(quinolin-7-yl)methanol
CID 81215665
1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine
CID 81229901
cyclopentyl(naphthalen-2-yl)methanol
CID 62715022
(2-cyclopentyl-1-quinolin-7-ylethyl)hydrazine
CID 105327558
2-cycloheptyl-1-quinolin-6-ylethanol
CID 115826801
oxan-3-yl(quinolin-6-yl)methanol
CID 81215748
oxan-3-yl(quinolin-7-yl)methanamine
CID 81231409
1,4-diazabicyclo[2.2.2]octan-2-yl(quinolin-7-yl)methanol
CID 81210048
quinolin-7-yl(thiolan-3-yl)methanamine
CID 105172672

Frequently Asked Questions

What is the IUPAC name of cycloheptyl(quinolin-7-yl)methanol?
The IUPAC name of cycloheptyl(quinolin-7-yl)methanol (CID 81216722) is cycloheptyl(quinolin-7-yl)methanol.
What is the SMILES notation for cycloheptyl(quinolin-7-yl)methanol?
The canonical SMILES for cycloheptyl(quinolin-7-yl)methanol is OC(c1ccc2cccnc2c1)C1CCCCCC1.
What is the InChIKey of cycloheptyl(quinolin-7-yl)methanol?
The InChIKey is RDBZZELRZUALMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c19-17(14-6-3-1-2-4-7-14)15-10-9-13-8-5-11-18-16(13)12-15/h5,8-12,14,17,19H,1-4,6-7H2.
What are the key properties of cycloheptyl(quinolin-7-yl)methanol?
cycloheptyl(quinolin-7-yl)methanol has a molecular weight of 255.36 g/mol, XLogP of 4.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cycloheptyl(quinolin-7-yl)methanol is sourced from PubChem (CID 81216722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).