1-naphthalen-1-ylnonan-2-ol

C19H26O — CID 19902465

IUPAC1-naphthalen-1-ylnonan-2-ol
SMILESCCCCCCCC(O)Cc1cccc2ccccc12
InChIInChI=1S/C19H26O/c1-2-3-4-5-6-13-18(20)15-17-12-9-11-16-10-7-8-14-19(16)17/h7-12,14,18,20H,2-6,13,15H2,1H3
InChIKeyWZYNXNWFQYXDOC-UHFFFAOYSA-N
MW270.42 g/mol
LogP5.10
Rot. Bonds8

About 1-naphthalen-1-ylnonan-2-ol

1-naphthalen-1-ylnonan-2-ol (PubChem CID 19902465) has the molecular formula C19H26O and a molecular weight of 270.42 g/mol. Its IUPAC name is 1-naphthalen-1-ylnonan-2-ol.

Molecular Properties

Compound Name1-naphthalen-1-ylnonan-2-ol
PubChem CID19902465
Molecular FormulaC19H26O
Molecular Weight270.42 g/mol
Exact Mass270.20
IUPAC Name1-naphthalen-1-ylnonan-2-ol
SMILESCCCCCCCC(O)Cc1cccc2ccccc12
InChIInChI=1S/C19H26O/c1-2-3-4-5-6-13-18(20)15-17-12-9-11-16-10-7-8-14-19(16)17/h7-12,14,18,20H,2-6,13,15H2,1H3
InChIKeyWZYNXNWFQYXDOC-UHFFFAOYSA-N
XLogP5.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.42
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-naphthalen-1-ylnonan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-methylhexadecyl)naphthalene
CID 139758361
6-methyl-1-naphthalen-1-ylheptan-2-ol
CID 105122822
1-(2-bromodecyl)naphthalene
CID 65428546
5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol
CID 70057285
1-(2-fluorophenyl)octan-2-ol
CID 62606363
5,5-dimethyl-1-naphthalen-1-ylhexan-2-ol
CID 105091563
4-(diethylamino)-1-naphthalen-1-ylbutan-2-ol
CID 79086780
1-(2,3-difluorophenyl)dodecan-2-ol
CID 115789113
1-[2-(nitrosomethyl)phenyl]octan-2-ol
CID 54314605
1-(2,3-dichlorophenyl)heptan-2-ol
CID 107307492
1-(3-chloro-2-fluorophenyl)decan-2-ol
CID 82803410
1-naphthalen-1-yloxyundecan-2-ol
CID 2793899

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-ylnonan-2-ol?
The IUPAC name of 1-naphthalen-1-ylnonan-2-ol (CID 19902465) is 1-naphthalen-1-ylnonan-2-ol.
What is the SMILES notation for 1-naphthalen-1-ylnonan-2-ol?
The canonical SMILES for 1-naphthalen-1-ylnonan-2-ol is CCCCCCCC(O)Cc1cccc2ccccc12.
What is the InChIKey of 1-naphthalen-1-ylnonan-2-ol?
The InChIKey is WZYNXNWFQYXDOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26O/c1-2-3-4-5-6-13-18(20)15-17-12-9-11-16-10-7-8-14-19(16)17/h7-12,14,18,20H,2-6,13,15H2,1H3.
What are the key properties of 1-naphthalen-1-ylnonan-2-ol?
1-naphthalen-1-ylnonan-2-ol has a molecular weight of 270.42 g/mol, XLogP of 5.10, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-ylnonan-2-ol is sourced from PubChem (CID 19902465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).