N-decyl-N-methylformamide

C12H25NO — CID 14151221

IUPACN-decyl-N-methylformamide
SMILESCCCCCCCCCCN(C)C=O
InChIInChI=1S/C12H25NO/c1-3-4-5-6-7-8-9-10-11-13(2)12-14/h12H,3-11H2,1-2H3
InChIKeyQXIZAWNNZNTKEI-UHFFFAOYSA-N
MW199.34 g/mol
LogP3.22
Rot. Bonds10

About N-decyl-N-methylformamide

N-decyl-N-methylformamide (PubChem CID 14151221) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is N-decyl-N-methylformamide.

Molecular Properties

Compound NameN-decyl-N-methylformamide
PubChem CID14151221
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC NameN-decyl-N-methylformamide
SMILESCCCCCCCCCCN(C)C=O
InChIInChI=1S/C12H25NO/c1-3-4-5-6-7-8-9-10-11-13(2)12-14/h12H,3-11H2,1-2H3
InChIKeyQXIZAWNNZNTKEI-UHFFFAOYSA-N
XLogP3.22
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-decyl-N-methylformamide?
The IUPAC name of N-decyl-N-methylformamide (CID 14151221) is N-decyl-N-methylformamide.
What is the SMILES notation for N-decyl-N-methylformamide?
The canonical SMILES for N-decyl-N-methylformamide is CCCCCCCCCCN(C)C=O.
What is the InChIKey of N-decyl-N-methylformamide?
The InChIKey is QXIZAWNNZNTKEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-3-4-5-6-7-8-9-10-11-13(2)12-14/h12H,3-11H2,1-2H3.
What are the key properties of N-decyl-N-methylformamide?
N-decyl-N-methylformamide has a molecular weight of 199.34 g/mol, XLogP of 3.22, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-decyl-N-methylformamide is sourced from PubChem (CID 14151221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).