2-(2-methoxyanilino)-2-methylnonan-1-ol

C17H29NO2 — CID 61050086

IUPAC2-(2-methoxyanilino)-2-methylnonan-1-ol
SMILESCCCCCCCC(C)(CO)Nc1ccccc1OC
InChIInChI=1S/C17H29NO2/c1-4-5-6-7-10-13-17(2,14-19)18-15-11-8-9-12-16(15)20-3/h8-9,11-12,18-19H,4-7,10,13-14H2,1-3H3
InChIKeyWJALGNMSOCHDLC-UHFFFAOYSA-N
MW279.42 g/mol
LogP4.22
Rot. Bonds10

About 2-(2-methoxyanilino)-2-methylnonan-1-ol

2-(2-methoxyanilino)-2-methylnonan-1-ol (PubChem CID 61050086) has the molecular formula C17H29NO2 and a molecular weight of 279.42 g/mol. Its IUPAC name is 2-(2-methoxyanilino)-2-methylnonan-1-ol.

Molecular Properties

Compound Name2-(2-methoxyanilino)-2-methylnonan-1-ol
PubChem CID61050086
Molecular FormulaC17H29NO2
Molecular Weight279.42 g/mol
Exact Mass279.22
IUPAC Name2-(2-methoxyanilino)-2-methylnonan-1-ol
SMILESCCCCCCCC(C)(CO)Nc1ccccc1OC
InChIInChI=1S/C17H29NO2/c1-4-5-6-7-10-13-17(2,14-19)18-15-11-8-9-12-16(15)20-3/h8-9,11-12,18-19H,4-7,10,13-14H2,1-3H3
InChIKeyWJALGNMSOCHDLC-UHFFFAOYSA-N
XLogP4.22
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.42
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-fluoroanilino)-2-methylnonan-1-ol
CID 55198849
4-methoxy-2-(2-methoxyanilino)-2,4-dimethylpentan-1-ol
CID 61050474
2-(3-methoxyanilino)-2-methylheptan-1-ol
CID 80558936
2-ethyl-2-(2-methoxyanilino)butan-1-ol
CID 61049290
6,6,6-trifluoro-2-N-(2-methoxyphenyl)-2-methylhexane-1,2-diamine
CID 116535345
2-(2-methoxyanilino)-2,3-dimethylbutan-1-ol
CID 62488457
1-methoxy-2-(2-methylundecan-2-yl)benzene
CID 56625929
1-methoxy-2-(9-methylnonadecan-9-yl)benzene
CID 135163718
2-(2-methoxyanilino)-2-propylpentanoic acid
CID 60993872
2-(ethylamino)-6-(2-methoxy-N-methylanilino)-2-methylhexan-1-ol
CID 64790716
2-(ethylamino)-6-(2-methoxyphenyl)sulfanyl-2-methylhexan-1-ol
CID 64821924
2-(3-bromoanilino)-2-methylnonan-1-ol
CID 55198657

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyanilino)-2-methylnonan-1-ol?
The IUPAC name of 2-(2-methoxyanilino)-2-methylnonan-1-ol (CID 61050086) is 2-(2-methoxyanilino)-2-methylnonan-1-ol.
What is the SMILES notation for 2-(2-methoxyanilino)-2-methylnonan-1-ol?
The canonical SMILES for 2-(2-methoxyanilino)-2-methylnonan-1-ol is CCCCCCCC(C)(CO)Nc1ccccc1OC.
What is the InChIKey of 2-(2-methoxyanilino)-2-methylnonan-1-ol?
The InChIKey is WJALGNMSOCHDLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO2/c1-4-5-6-7-10-13-17(2,14-19)18-15-11-8-9-12-16(15)20-3/h8-9,11-12,18-19H,4-7,10,13-14H2,1-3H3.
What are the key properties of 2-(2-methoxyanilino)-2-methylnonan-1-ol?
2-(2-methoxyanilino)-2-methylnonan-1-ol has a molecular weight of 279.42 g/mol, XLogP of 4.22, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyanilino)-2-methylnonan-1-ol is sourced from PubChem (CID 61050086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).