6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol

C15H24N2O — CID 107704010

IUPAC6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol
SMILESNc1ccc2c(c1)CCCN2CCCCCCO
InChIInChI=1S/C15H24N2O/c16-14-7-8-15-13(12-14)6-5-10-17(15)9-3-1-2-4-11-18/h7-8,12,18H,1-6,9-11,16H2
InChIKeyASERXNWHXRDHEB-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.57
Rot. Bonds6

About 6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol

6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol (PubChem CID 107704010) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol.

Molecular Properties

Compound Name6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol
PubChem CID107704010
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol
SMILESNc1ccc2c(c1)CCCN2CCCCCCO
InChIInChI=1S/C15H24N2O/c16-14-7-8-15-13(12-14)6-5-10-17(15)9-3-1-2-4-11-18/h7-8,12,18H,1-6,9-11,16H2
InChIKeyASERXNWHXRDHEB-UHFFFAOYSA-N
XLogP2.57
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-(7-amino-3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol
CID 55055575
1-(4,4,4-trifluorobutyl)-3,4-dihydro-2H-quinolin-6-amine
CID 113326478
2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)ethanethiol
CID 59090152
5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol
CID 13472126
1-(3,3-dimethylbutyl)-3,4-dihydro-2H-quinolin-6-amine
CID 54957573
1-(3-methylbut-3-enyl)-3,4-dihydro-2H-quinolin-6-amine
CID 114473358
4-[6-(difluoromethoxy)-3,4-dihydro-2H-quinolin-1-yl]butan-1-ol
CID 110931720
1-heptyl-3,4-dihydro-2H-quinolin-7-amine
CID 62265158
1-(3-imidazol-1-ylpropyl)-3,4-dihydro-2H-quinolin-6-amine
CID 61493158
5-(7-amino-2,3-dihydro-1,4-benzoxazin-4-yl)pentan-1-ol
CID 118888976
1-(2-propan-2-yloxyethyl)-3,4-dihydro-2H-quinolin-6-amine
CID 54957754
4-[6-[1-(ethylamino)ethyl]-3,4-dihydro-2H-quinolin-1-yl]butan-1-ol
CID 102662106

Frequently Asked Questions

What is the IUPAC name of 6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol?
The IUPAC name of 6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol (CID 107704010) is 6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol.
What is the SMILES notation for 6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol?
The canonical SMILES for 6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol is Nc1ccc2c(c1)CCCN2CCCCCCO.
What is the InChIKey of 6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol?
The InChIKey is ASERXNWHXRDHEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c16-14-7-8-15-13(12-14)6-5-10-17(15)9-3-1-2-4-11-18/h7-8,12,18H,1-6,9-11,16H2.
What are the key properties of 6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol?
6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol has a molecular weight of 248.37 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol is sourced from PubChem (CID 107704010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).