N,N-dimethylmethanamine;tridecane

C16H37N — CID 174432259

IUPACN,N-dimethylmethanamine;tridecane
SMILESCCCCCCCCCCCCC.CN(C)C
InChIInChI=1S/C13H28.C3H9N/c1-3-5-7-9-11-13-12-10-8-6-4-2;1-4(2)3/h3-13H2,1-2H3;1-3H3
InChIKeyBTRJXGUKJFSAMM-UHFFFAOYSA-N
MW243.48 g/mol
LogP5.50
Rot. Bonds10

About N,N-dimethylmethanamine;tridecane

N,N-dimethylmethanamine;tridecane (PubChem CID 174432259) has the molecular formula C16H37N and a molecular weight of 243.48 g/mol. Its IUPAC name is N,N-dimethylmethanamine;tridecane.

Molecular Properties

Compound NameN,N-dimethylmethanamine;tridecane
PubChem CID174432259
Molecular FormulaC16H37N
Molecular Weight243.48 g/mol
Exact Mass243.29
IUPAC NameN,N-dimethylmethanamine;tridecane
SMILESCCCCCCCCCCCCC.CN(C)C
InChIInChI=1S/C13H28.C3H9N/c1-3-5-7-9-11-13-12-10-8-6-4-2;1-4(2)3/h3-13H2,1-2H3;1-3H3
InChIKeyBTRJXGUKJFSAMM-UHFFFAOYSA-N
XLogP5.50
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500243.48
LogP ≤ 55.50
H-Bond Donors ≤ 50
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 N,N-dimethylmethanamine;tridecane?
The IUPAC name of N,N-dimethylmethanamine;tridecane (CID 174432259) is N,N-dimethylmethanamine;tridecane.
What is the SMILES notation for N,N-dimethylmethanamine;tridecane?
The canonical SMILES for N,N-dimethylmethanamine;tridecane is CCCCCCCCCCCCC.CN(C)C.
What is the InChIKey of N,N-dimethylmethanamine;tridecane?
The InChIKey is BTRJXGUKJFSAMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28.C3H9N/c1-3-5-7-9-11-13-12-10-8-6-4-2;1-4(2)3/h3-13H2,1-2H3;1-3H3.
What are the key properties of N,N-dimethylmethanamine;tridecane?
N,N-dimethylmethanamine;tridecane has a molecular weight of 243.48 g/mol, XLogP of 5.50, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylmethanamine;tridecane is sourced from PubChem (CID 174432259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).