N-decyl-N-(2-methoxyethyl)decan-1-amine

C23H49NO — CID 6426280

IUPACN-decyl-N-(2-methoxyethyl)decan-1-amine
SMILESCCCCCCCCCCN(CCCCCCCCCC)CCOC
InChIInChI=1S/C23H49NO/c1-4-6-8-10-12-14-16-18-20-24(22-23-25-3)21-19-17-15-13-11-9-7-5-2/h4-23H2,1-3H3
InChIKeyDBWZVMUOFLOYKQ-UHFFFAOYSA-N
MW355.65 g/mol
LogP7.22
Rot. Bonds21

About N-decyl-N-(2-methoxyethyl)decan-1-amine

N-decyl-N-(2-methoxyethyl)decan-1-amine (PubChem CID 6426280) has the molecular formula C23H49NO and a molecular weight of 355.65 g/mol. Its IUPAC name is N-decyl-N-(2-methoxyethyl)decan-1-amine.

Molecular Properties

Compound NameN-decyl-N-(2-methoxyethyl)decan-1-amine
PubChem CID6426280
Molecular FormulaC23H49NO
Molecular Weight355.65 g/mol
Exact Mass355.38
IUPAC NameN-decyl-N-(2-methoxyethyl)decan-1-amine
SMILESCCCCCCCCCCN(CCCCCCCCCC)CCOC
InChIInChI=1S/C23H49NO/c1-4-6-8-10-12-14-16-18-20-24(22-23-25-3)21-19-17-15-13-11-9-7-5-2/h4-23H2,1-3H3
InChIKeyDBWZVMUOFLOYKQ-UHFFFAOYSA-N
XLogP7.22
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds21
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.65
LogP ≤ 57.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-decyl-N-(2-methoxyethyl)decan-1-amine?
The IUPAC name of N-decyl-N-(2-methoxyethyl)decan-1-amine (CID 6426280) is N-decyl-N-(2-methoxyethyl)decan-1-amine.
What is the SMILES notation for N-decyl-N-(2-methoxyethyl)decan-1-amine?
The canonical SMILES for N-decyl-N-(2-methoxyethyl)decan-1-amine is CCCCCCCCCCN(CCCCCCCCCC)CCOC.
What is the InChIKey of N-decyl-N-(2-methoxyethyl)decan-1-amine?
The InChIKey is DBWZVMUOFLOYKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H49NO/c1-4-6-8-10-12-14-16-18-20-24(22-23-25-3)21-19-17-15-13-11-9-7-5-2/h4-23H2,1-3H3.
What are the key properties of N-decyl-N-(2-methoxyethyl)decan-1-amine?
N-decyl-N-(2-methoxyethyl)decan-1-amine has a molecular weight of 355.65 g/mol, XLogP of 7.22, 21 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-decyl-N-(2-methoxyethyl)decan-1-amine is sourced from PubChem (CID 6426280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).