10-methyl-N-(10-methylundecyl)undecan-1-amine

C24H51N — CID 22625170

IUPAC10-methyl-N-(10-methylundecyl)undecan-1-amine
SMILESCC(C)CCCCCCCCCNCCCCCCCCCC(C)C
InChIInChI=1S/C24H51N/c1-23(2)19-15-11-7-5-9-13-17-21-25-22-18-14-10-6-8-12-16-20-24(3)4/h23-25H,5-22H2,1-4H3
InChIKeyKWLXMHPDSIQHDF-UHFFFAOYSA-N
MW353.68 g/mol
LogP8.13
Rot. Bonds20

About 10-methyl-N-(10-methylundecyl)undecan-1-amine

10-methyl-N-(10-methylundecyl)undecan-1-amine (PubChem CID 22625170) has the molecular formula C24H51N and a molecular weight of 353.68 g/mol. Its IUPAC name is 10-methyl-N-(10-methylundecyl)undecan-1-amine.

Molecular Properties

Compound Name10-methyl-N-(10-methylundecyl)undecan-1-amine
PubChem CID22625170
Molecular FormulaC24H51N
Molecular Weight353.68 g/mol
Exact Mass353.40
IUPAC Name10-methyl-N-(10-methylundecyl)undecan-1-amine
SMILESCC(C)CCCCCCCCCNCCCCCCCCCC(C)C
InChIInChI=1S/C24H51N/c1-23(2)19-15-11-7-5-9-13-17-21-25-22-18-14-10-6-8-12-16-20-24(3)4/h23-25H,5-22H2,1-4H3
InChIKeyKWLXMHPDSIQHDF-UHFFFAOYSA-N
XLogP8.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds20
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.68
LogP ≤ 58.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 10-methyl-N-(10-methylundecyl)undecan-1-amine?
The IUPAC name of 10-methyl-N-(10-methylundecyl)undecan-1-amine (CID 22625170) is 10-methyl-N-(10-methylundecyl)undecan-1-amine.
What is the SMILES notation for 10-methyl-N-(10-methylundecyl)undecan-1-amine?
The canonical SMILES for 10-methyl-N-(10-methylundecyl)undecan-1-amine is CC(C)CCCCCCCCCNCCCCCCCCCC(C)C.
What is the InChIKey of 10-methyl-N-(10-methylundecyl)undecan-1-amine?
The InChIKey is KWLXMHPDSIQHDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H51N/c1-23(2)19-15-11-7-5-9-13-17-21-25-22-18-14-10-6-8-12-16-20-24(3)4/h23-25H,5-22H2,1-4H3.
What are the key properties of 10-methyl-N-(10-methylundecyl)undecan-1-amine?
10-methyl-N-(10-methylundecyl)undecan-1-amine has a molecular weight of 353.68 g/mol, XLogP of 8.13, 20 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-N-(10-methylundecyl)undecan-1-amine is sourced from PubChem (CID 22625170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).