2-methyldecan-2-amine

C11H25N — CID 22341686

IUPAC2-methyldecan-2-amine
SMILESCCCCCCCCC(C)(C)N
InChIInChI=1S/C11H25N/c1-4-5-6-7-8-9-10-11(2,3)12/h4-10,12H2,1-3H3
InChIKeyFNVKKTKUHFPYAW-UHFFFAOYSA-N
MW171.33 g/mol
LogP3.47
Rot. Bonds7

About 2-methyldecan-2-amine

2-methyldecan-2-amine (PubChem CID 22341686) has the molecular formula C11H25N and a molecular weight of 171.33 g/mol. Its IUPAC name is 2-methyldecan-2-amine.

Molecular Properties

Compound Name2-methyldecan-2-amine
PubChem CID22341686
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC Name2-methyldecan-2-amine
SMILESCCCCCCCCC(C)(C)N
InChIInChI=1S/C11H25N/c1-4-5-6-7-8-9-10-11(2,3)12/h4-10,12H2,1-3H3
InChIKeyFNVKKTKUHFPYAW-UHFFFAOYSA-N
XLogP3.47
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.33
LogP ≤ 53.47
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 2-methyldecan-2-amine?
The IUPAC name of 2-methyldecan-2-amine (CID 22341686) is 2-methyldecan-2-amine.
What is the SMILES notation for 2-methyldecan-2-amine?
The canonical SMILES for 2-methyldecan-2-amine is CCCCCCCCC(C)(C)N.
What is the InChIKey of 2-methyldecan-2-amine?
The InChIKey is FNVKKTKUHFPYAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N/c1-4-5-6-7-8-9-10-11(2,3)12/h4-10,12H2,1-3H3.
What are the key properties of 2-methyldecan-2-amine?
2-methyldecan-2-amine has a molecular weight of 171.33 g/mol, XLogP of 3.47, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyldecan-2-amine is sourced from PubChem (CID 22341686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).