[8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol

C19H23NO — CID 59368748

IUPAC[8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol
SMILESCc1c(CO)ccc2c1N(CCc1ccccc1)CCC2
InChIInChI=1S/C19H23NO/c1-15-18(14-21)10-9-17-8-5-12-20(19(15)17)13-11-16-6-3-2-4-7-16/h2-4,6-7,9-10,21H,5,8,11-14H2,1H3
InChIKeyBMKMSIHUPBHOCF-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.48
Rot. Bonds4

About [8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol

[8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol (PubChem CID 59368748) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is [8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol.

Molecular Properties

Compound Name[8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol
PubChem CID59368748
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name[8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol
SMILESCc1c(CO)ccc2c1N(CCc1ccccc1)CCC2
InChIInChI=1S/C19H23NO/c1-15-18(14-21)10-9-17-8-5-12-20(19(15)17)13-11-16-6-3-2-4-7-16/h2-4,6-7,9-10,21H,5,8,11-14H2,1H3
InChIKeyBMKMSIHUPBHOCF-UHFFFAOYSA-N
XLogP3.48
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol?
The IUPAC name of [8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol (CID 59368748) is [8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol.
What is the SMILES notation for [8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol?
The canonical SMILES for [8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol is Cc1c(CO)ccc2c1N(CCc1ccccc1)CCC2.
What is the InChIKey of [8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol?
The InChIKey is BMKMSIHUPBHOCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-15-18(14-21)10-9-17-8-5-12-20(19(15)17)13-11-16-6-3-2-4-7-16/h2-4,6-7,9-10,21H,5,8,11-14H2,1H3.
What are the key properties of [8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol?
[8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol has a molecular weight of 281.40 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [8-methyl-1-(2-phenylethyl)-3,4-dihydro-2H-quinolin-7-yl]methanol is sourced from PubChem (CID 59368748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).