(1S)-1-quinolin-7-ylnonan-1-ol

C18H25NO — CID 15658090

IUPAC(1S)-1-quinolin-7-ylnonan-1-ol
SMILESCCCCCCCC[C@H](O)c1ccc2cccnc2c1
InChIInChI=1S/C18H25NO/c1-2-3-4-5-6-7-10-18(20)16-12-11-15-9-8-13-19-17(15)14-16/h8-9,11-14,18,20H,2-7,10H2,1H3/t18-/m0/s1
InChIKeyJVKCMPBSEMRUAF-SFHVURJKSA-N
MW271.40 g/mol
LogP5.02
Rot. Bonds8

About (1S)-1-quinolin-7-ylnonan-1-ol

(1S)-1-quinolin-7-ylnonan-1-ol (PubChem CID 15658090) has the molecular formula C18H25NO and a molecular weight of 271.40 g/mol. Its IUPAC name is (1S)-1-quinolin-7-ylnonan-1-ol.

Molecular Properties

Compound Name(1S)-1-quinolin-7-ylnonan-1-ol
PubChem CID15658090
Molecular FormulaC18H25NO
Molecular Weight271.40 g/mol
Exact Mass271.19
IUPAC Name(1S)-1-quinolin-7-ylnonan-1-ol
SMILESCCCCCCCC[C@H](O)c1ccc2cccnc2c1
InChIInChI=1S/C18H25NO/c1-2-3-4-5-6-7-10-18(20)16-12-11-15-9-8-13-19-17(15)14-16/h8-9,11-14,18,20H,2-7,10H2,1H3/t18-/m0/s1
InChIKeyJVKCMPBSEMRUAF-SFHVURJKSA-N
XLogP5.02
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500271.40
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-amino-1-quinolin-7-ylpropan-1-ol
CID 84670752
3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-ol
CID 105118985
2-methyl-1-quinolin-7-ylhexan-1-amine
CID 114246526
7-(1-hydroxynonyl)quinoline-2-carboxylic acid
CID 54296582
1-quinolin-6-yldecan-1-amine
CID 63418413
2-(2-methylpropylamino)-1-quinolin-7-ylethanol
CID 81221212
2-(2-bromophenyl)-1-quinolin-7-ylethanol
CID 81220436
N,2-diethyl-1-quinolin-7-ylhexan-1-amine
CID 105021496
2,2-diethoxy-1-quinolin-7-ylethanol
CID 81220002
1-quinolin-7-ylpropane-1,2,3-triol
CID 170818071
ethyl 3-methyl-2-quinolin-7-ylbutanoate
CID 81224996
N-ethyl-1-quinolin-7-ylethanamine
CID 81221005

Frequently Asked Questions

What is the IUPAC name of (1S)-1-quinolin-7-ylnonan-1-ol?
The IUPAC name of (1S)-1-quinolin-7-ylnonan-1-ol (CID 15658090) is (1S)-1-quinolin-7-ylnonan-1-ol.
What is the SMILES notation for (1S)-1-quinolin-7-ylnonan-1-ol?
The canonical SMILES for (1S)-1-quinolin-7-ylnonan-1-ol is CCCCCCCC[C@H](O)c1ccc2cccnc2c1.
What is the InChIKey of (1S)-1-quinolin-7-ylnonan-1-ol?
The InChIKey is JVKCMPBSEMRUAF-SFHVURJKSA-N. The full InChI is InChI=1S/C18H25NO/c1-2-3-4-5-6-7-10-18(20)16-12-11-15-9-8-13-19-17(15)14-16/h8-9,11-14,18,20H,2-7,10H2,1H3/t18-/m0/s1.
What are the key properties of (1S)-1-quinolin-7-ylnonan-1-ol?
(1S)-1-quinolin-7-ylnonan-1-ol has a molecular weight of 271.40 g/mol, XLogP of 5.02, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-quinolin-7-ylnonan-1-ol is sourced from PubChem (CID 15658090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).