10-(4-anilinophenyl)decan-5-ol

C22H31NO — CID 101298269

IUPAC10-(4-anilinophenyl)decan-5-ol
SMILESCCCCC(O)CCCCCc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C22H31NO/c1-2-3-13-22(24)14-9-4-6-10-19-15-17-21(18-16-19)23-20-11-7-5-8-12-20/h5,7-8,11-12,15-18,22-24H,2-4,6,9-10,13-14H2,1H3
InChIKeySOXUMUFVJFXBHG-UHFFFAOYSA-N
MW325.50 g/mol
LogP6.08
Rot. Bonds11

About 10-(4-anilinophenyl)decan-5-ol

10-(4-anilinophenyl)decan-5-ol (PubChem CID 101298269) has the molecular formula C22H31NO and a molecular weight of 325.50 g/mol. Its IUPAC name is 10-(4-anilinophenyl)decan-5-ol.

Molecular Properties

Compound Name10-(4-anilinophenyl)decan-5-ol
PubChem CID101298269
Molecular FormulaC22H31NO
Molecular Weight325.50 g/mol
Exact Mass325.24
IUPAC Name10-(4-anilinophenyl)decan-5-ol
SMILESCCCCC(O)CCCCCc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C22H31NO/c1-2-3-13-22(24)14-9-4-6-10-19-15-17-21(18-16-19)23-20-11-7-5-8-12-20/h5,7-8,11-12,15-18,22-24H,2-4,6,9-10,13-14H2,1H3
InChIKeySOXUMUFVJFXBHG-UHFFFAOYSA-N
XLogP6.08
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.50
LogP ≤ 56.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

17-(4-anilinophenyl)heptadecan-5-ol
CID 101298360
1-(4-anilinophenyl)pentadecan-8-ol
CID 101298332
1-(4-anilinophenyl)octadecan-8-ol
CID 101298383
1-(4-anilinophenyl)tridecan-5-ol
CID 101298306
1-(4-anilinophenyl)undecan-4-ol
CID 101298282
7-(4-anilinophenyl)heptan-2-ol
CID 101298242
10-(4-anilinophenyl)decan-2-ol
CID 101298266
15-(4-anilinophenyl)pentadecan-2-ol
CID 101298326
4-(4-butylphenyl)-N-phenylaniline
CID 141426915
1-phenylheptan-3-ol
CID 10420110
12-(4-anilinophenyl)dodecan-1-ol
CID 101298286
4-(4-hexylanilino)phenol
CID 101298409

Frequently Asked Questions

What is the IUPAC name of 10-(4-anilinophenyl)decan-5-ol?
The IUPAC name of 10-(4-anilinophenyl)decan-5-ol (CID 101298269) is 10-(4-anilinophenyl)decan-5-ol.
What is the SMILES notation for 10-(4-anilinophenyl)decan-5-ol?
The canonical SMILES for 10-(4-anilinophenyl)decan-5-ol is CCCCC(O)CCCCCc1ccc(Nc2ccccc2)cc1.
What is the InChIKey of 10-(4-anilinophenyl)decan-5-ol?
The InChIKey is SOXUMUFVJFXBHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31NO/c1-2-3-13-22(24)14-9-4-6-10-19-15-17-21(18-16-19)23-20-11-7-5-8-12-20/h5,7-8,11-12,15-18,22-24H,2-4,6,9-10,13-14H2,1H3.
What are the key properties of 10-(4-anilinophenyl)decan-5-ol?
10-(4-anilinophenyl)decan-5-ol has a molecular weight of 325.50 g/mol, XLogP of 6.08, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4-anilinophenyl)decan-5-ol is sourced from PubChem (CID 101298269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).