N-decyl-N-dodecylformamide

C23H47NO — CID 174803125

IUPACN-decyl-N-dodecylformamide
SMILESCCCCCCCCCCCCN(C=O)CCCCCCCCCC
InChIInChI=1S/C23H47NO/c1-3-5-7-9-11-13-14-16-18-20-22-24(23-25)21-19-17-15-12-10-8-6-4-2/h23H,3-22H2,1-2H3
InChIKeyGXUTWYKRXSGTDL-UHFFFAOYSA-N
MW353.64 g/mol
LogP7.51
Rot. Bonds21

About N-decyl-N-dodecylformamide

N-decyl-N-dodecylformamide (PubChem CID 174803125) has the molecular formula C23H47NO and a molecular weight of 353.64 g/mol. Its IUPAC name is N-decyl-N-dodecylformamide.

Molecular Properties

Compound NameN-decyl-N-dodecylformamide
PubChem CID174803125
Molecular FormulaC23H47NO
Molecular Weight353.64 g/mol
Exact Mass353.37
IUPAC NameN-decyl-N-dodecylformamide
SMILESCCCCCCCCCCCCN(C=O)CCCCCCCCCC
InChIInChI=1S/C23H47NO/c1-3-5-7-9-11-13-14-16-18-20-22-24(23-25)21-19-17-15-12-10-8-6-4-2/h23H,3-22H2,1-2H3
InChIKeyGXUTWYKRXSGTDL-UHFFFAOYSA-N
XLogP7.51
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds21
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.64
LogP ≤ 57.51
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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Related Compounds

N-hexyl-N-octylformamide
CID 169189817
N-butyl-N-octadecylformamide
CID 54030417
N-ethyl-N-hexylformamide
CID 54565973
N-decyl-N-(2-methylpropyl)formamide
CID 12622742
2-[butyl(formyl)amino]ethylmercury
CID 142121724
N,N-dimethylformamide;dodecane
CID 174900991
N-methyl-N-tetradecylformamide
CID 10422507
(E)-3-(dioctylamino)prop-2-enal
CID 134949607
disodium;N-dodecyl-N-[2-(dodecylamino)ethyl]formamide;diacetate
CID 175796205
N-butyl-N-[2-(methylamino)ethyl]formamide
CID 23084470
N-methyl-N-pentylformamide
CID 22754748
N-(5-aminopentyl)-N-ethylformamide
CID 155337011

Frequently Asked Questions

What is the IUPAC name of N-decyl-N-dodecylformamide?
The IUPAC name of N-decyl-N-dodecylformamide (CID 174803125) is N-decyl-N-dodecylformamide.
What is the SMILES notation for N-decyl-N-dodecylformamide?
The canonical SMILES for N-decyl-N-dodecylformamide is CCCCCCCCCCCCN(C=O)CCCCCCCCCC.
What is the InChIKey of N-decyl-N-dodecylformamide?
The InChIKey is GXUTWYKRXSGTDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H47NO/c1-3-5-7-9-11-13-14-16-18-20-22-24(23-25)21-19-17-15-12-10-8-6-4-2/h23H,3-22H2,1-2H3.
What are the key properties of N-decyl-N-dodecylformamide?
N-decyl-N-dodecylformamide has a molecular weight of 353.64 g/mol, XLogP of 7.51, 21 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-decyl-N-dodecylformamide is sourced from PubChem (CID 174803125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).