2-(dimethylamino)-2-methyltetradecanoic acid

C17H35NO2 — CID 11565995

IUPAC2-(dimethylamino)-2-methyltetradecanoic acid
SMILESCCCCCCCCCCCCC(C)(C(=O)O)N(C)C
InChIInChI=1S/C17H35NO2/c1-5-6-7-8-9-10-11-12-13-14-15-17(2,16(19)20)18(3)4/h5-15H2,1-4H3,(H,19,20)
InChIKeyACBHVYJPUXNHEJ-UHFFFAOYSA-N
MW285.47 g/mol
LogP4.70
Rot. Bonds13

About 2-(dimethylamino)-2-methyltetradecanoic acid

2-(dimethylamino)-2-methyltetradecanoic acid (PubChem CID 11565995) has the molecular formula C17H35NO2 and a molecular weight of 285.47 g/mol. Its IUPAC name is 2-(dimethylamino)-2-methyltetradecanoic acid.

Molecular Properties

Compound Name2-(dimethylamino)-2-methyltetradecanoic acid
PubChem CID11565995
Molecular FormulaC17H35NO2
Molecular Weight285.47 g/mol
Exact Mass285.27
IUPAC Name2-(dimethylamino)-2-methyltetradecanoic acid
SMILESCCCCCCCCCCCCC(C)(C(=O)O)N(C)C
InChIInChI=1S/C17H35NO2/c1-5-6-7-8-9-10-11-12-13-14-15-17(2,16(19)20)18(3)4/h5-15H2,1-4H3,(H,19,20)
InChIKeyACBHVYJPUXNHEJ-UHFFFAOYSA-N
XLogP4.70
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.47
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[acetyl(ethyl)amino]-2-methylnonanoic acid
CID 63701700
2-(dimethylamino)-2-octadecylicosanoic acid
CID 141120188
(2R)-2-hydroxy-2-methyloctadecanoic acid
CID 172684339
2-hydroxy-2-methylheptadecanoic acid
CID 19591844
2-heptyl-2-methylpropanedioic acid
CID 89147986
2-decyl-2-methyltetradecanoic acid
CID 611890
2,2-dimethyldocosanoic acid
CID 23471202
2-decyl-2-methylicosanoic acid
CID 174997379
2-hexyl-2-methyldecanoic acid
CID 86051716
2-(dimethylamino)heptadecan-2-ol
CID 57269512
2-[formyl(propyl)amino]-2-methylheptanoic acid
CID 80557943
tris(2,2-dimethyldecanoic acid);neodymium
CID 162514792

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-2-methyltetradecanoic acid?
The IUPAC name of 2-(dimethylamino)-2-methyltetradecanoic acid (CID 11565995) is 2-(dimethylamino)-2-methyltetradecanoic acid.
What is the SMILES notation for 2-(dimethylamino)-2-methyltetradecanoic acid?
The canonical SMILES for 2-(dimethylamino)-2-methyltetradecanoic acid is CCCCCCCCCCCCC(C)(C(=O)O)N(C)C.
What is the InChIKey of 2-(dimethylamino)-2-methyltetradecanoic acid?
The InChIKey is ACBHVYJPUXNHEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35NO2/c1-5-6-7-8-9-10-11-12-13-14-15-17(2,16(19)20)18(3)4/h5-15H2,1-4H3,(H,19,20).
What are the key properties of 2-(dimethylamino)-2-methyltetradecanoic acid?
2-(dimethylamino)-2-methyltetradecanoic acid has a molecular weight of 285.47 g/mol, XLogP of 4.70, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-2-methyltetradecanoic acid is sourced from PubChem (CID 11565995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).