15-(4-anilinophenyl)pentadecan-2-ol

C27H41NO — CID 101298326

IUPAC15-(4-anilinophenyl)pentadecan-2-ol
SMILESCC(O)CCCCCCCCCCCCCc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C27H41NO/c1-24(29)16-12-9-7-5-3-2-4-6-8-10-13-17-25-20-22-27(23-21-25)28-26-18-14-11-15-19-26/h11,14-15,18-24,28-29H,2-10,12-13,16-17H2,1H3
InChIKeySFTJLLDIKNCLIL-UHFFFAOYSA-N
MW395.63 g/mol
LogP8.03
Rot. Bonds16

About 15-(4-anilinophenyl)pentadecan-2-ol

15-(4-anilinophenyl)pentadecan-2-ol (PubChem CID 101298326) has the molecular formula C27H41NO and a molecular weight of 395.63 g/mol. Its IUPAC name is 15-(4-anilinophenyl)pentadecan-2-ol.

Molecular Properties

Compound Name15-(4-anilinophenyl)pentadecan-2-ol
PubChem CID101298326
Molecular FormulaC27H41NO
Molecular Weight395.63 g/mol
Exact Mass395.32
IUPAC Name15-(4-anilinophenyl)pentadecan-2-ol
SMILESCC(O)CCCCCCCCCCCCCc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C27H41NO/c1-24(29)16-12-9-7-5-3-2-4-6-8-10-13-17-25-20-22-27(23-21-25)28-26-18-14-11-15-19-26/h11,14-15,18-24,28-29H,2-10,12-13,16-17H2,1H3
InChIKeySFTJLLDIKNCLIL-UHFFFAOYSA-N
XLogP8.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.63
LogP ≤ 58.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 15-(4-anilinophenyl)pentadecan-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

7-(4-anilinophenyl)heptan-2-ol
CID 101298242
10-(4-anilinophenyl)decan-2-ol
CID 101298266
10-(4-anilinophenyl)decan-5-ol
CID 101298269
1-(4-anilinophenyl)octadecan-8-ol
CID 101298383
1-(4-anilinophenyl)pentadecan-8-ol
CID 101298332
17-(4-anilinophenyl)heptadecan-5-ol
CID 101298360
1-(4-anilinophenyl)tridecan-5-ol
CID 101298306
1-(4-anilinophenyl)undecan-4-ol
CID 101298282
12-(4-anilinophenyl)dodecan-1-ol
CID 101298286
ethane;methanol;N-phenyl-4-(2-phenylethyl)aniline
CID 91580530
6-naphthalen-2-ylhexan-2-ol
CID 19933710
2-methyl-6-[4-(pyrimidin-2-ylamino)phenyl]hexanoic acid
CID 143251064

Frequently Asked Questions

What is the IUPAC name of 15-(4-anilinophenyl)pentadecan-2-ol?
The IUPAC name of 15-(4-anilinophenyl)pentadecan-2-ol (CID 101298326) is 15-(4-anilinophenyl)pentadecan-2-ol.
What is the SMILES notation for 15-(4-anilinophenyl)pentadecan-2-ol?
The canonical SMILES for 15-(4-anilinophenyl)pentadecan-2-ol is CC(O)CCCCCCCCCCCCCc1ccc(Nc2ccccc2)cc1.
What is the InChIKey of 15-(4-anilinophenyl)pentadecan-2-ol?
The InChIKey is SFTJLLDIKNCLIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H41NO/c1-24(29)16-12-9-7-5-3-2-4-6-8-10-13-17-25-20-22-27(23-21-25)28-26-18-14-11-15-19-26/h11,14-15,18-24,28-29H,2-10,12-13,16-17H2,1H3.
What are the key properties of 15-(4-anilinophenyl)pentadecan-2-ol?
15-(4-anilinophenyl)pentadecan-2-ol has a molecular weight of 395.63 g/mol, XLogP of 8.03, 16 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 15-(4-anilinophenyl)pentadecan-2-ol is sourced from PubChem (CID 101298326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).