10-anilinodecan-1-ol

C16H27NO — CID 10955954

IUPAC10-anilinodecan-1-ol
SMILESOCCCCCCCCCCNc1ccccc1
InChIInChI=1S/C16H27NO/c18-15-11-6-4-2-1-3-5-10-14-17-16-12-8-7-9-13-16/h7-9,12-13,17-18H,1-6,10-11,14-15H2
InChIKeyNPFXOQVBJWZBLD-UHFFFAOYSA-N
MW249.40 g/mol
LogP4.21
Rot. Bonds11

About 10-anilinodecan-1-ol

10-anilinodecan-1-ol (PubChem CID 10955954) has the molecular formula C16H27NO and a molecular weight of 249.40 g/mol. Its IUPAC name is 10-anilinodecan-1-ol.

Molecular Properties

Compound Name10-anilinodecan-1-ol
PubChem CID10955954
Molecular FormulaC16H27NO
Molecular Weight249.40 g/mol
Exact Mass249.21
IUPAC Name10-anilinodecan-1-ol
SMILESOCCCCCCCCCCNc1ccccc1
InChIInChI=1S/C16H27NO/c18-15-11-6-4-2-1-3-5-10-14-17-16-12-8-7-9-13-16/h7-9,12-13,17-18H,1-6,10-11,14-15H2
InChIKeyNPFXOQVBJWZBLD-UHFFFAOYSA-N
XLogP4.21
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 54.21
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

3-anilinopropan-1-ol;phosphoric acid
CID 66984453
5-[2-(5-hydroxypentylamino)anilino]pentan-1-ol
CID 165350008
6-(3-phenoxyanilino)hexan-1-ol
CID 103867980
5-(4-bromoanilino)pentan-1-ol
CID 62227139
4-[4-(2-phenoxyethoxy)anilino]butan-1-ol
CID 54803419
N,N'-diphenylpropane-1,3-diamine;hydrochloride
CID 68721632
N-(5-bromopentyl)aniline
CID 20759134
N-nonadecylaniline
CID 54509054
N'-phenylheptane-1,7-diamine
CID 61149618
5-[4-(2-hydroxyethyl)anilino]pentan-1-ol
CID 83962274
5-(3-iodoanilino)pentan-1-ol
CID 62228446
5-(3-bromoanilino)pentan-1-ol
CID 62227140

Frequently Asked Questions

What is the IUPAC name of 10-anilinodecan-1-ol?
The IUPAC name of 10-anilinodecan-1-ol (CID 10955954) is 10-anilinodecan-1-ol.
What is the SMILES notation for 10-anilinodecan-1-ol?
The canonical SMILES for 10-anilinodecan-1-ol is OCCCCCCCCCCNc1ccccc1.
What is the InChIKey of 10-anilinodecan-1-ol?
The InChIKey is NPFXOQVBJWZBLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO/c18-15-11-6-4-2-1-3-5-10-14-17-16-12-8-7-9-13-16/h7-9,12-13,17-18H,1-6,10-11,14-15H2.
What are the key properties of 10-anilinodecan-1-ol?
10-anilinodecan-1-ol has a molecular weight of 249.40 g/mol, XLogP of 4.21, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-anilinodecan-1-ol is sourced from PubChem (CID 10955954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).