5-methyl-N,N-dipentylfuran-2-carboxamide

C16H27NO2 — CID 3319656

IUPAC5-methyl-N,N-dipentylfuran-2-carboxamide
SMILESCCCCCN(CCCCC)C(=O)c1ccc(C)o1
InChIInChI=1S/C16H27NO2/c1-4-6-8-12-17(13-9-7-5-2)16(18)15-11-10-14(3)19-15/h10-11H,4-9,12-13H2,1-3H3
InChIKeyJNVQHUPLMRIIGR-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.41
Rot. Bonds9

About 5-methyl-N,N-dipentylfuran-2-carboxamide

5-methyl-N,N-dipentylfuran-2-carboxamide (PubChem CID 3319656) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 5-methyl-N,N-dipentylfuran-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N,N-dipentylfuran-2-carboxamide
PubChem CID3319656
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name5-methyl-N,N-dipentylfuran-2-carboxamide
SMILESCCCCCN(CCCCC)C(=O)c1ccc(C)o1
InChIInChI=1S/C16H27NO2/c1-4-6-8-12-17(13-9-7-5-2)16(18)15-11-10-14(3)19-15/h10-11H,4-9,12-13H2,1-3H3
InChIKeyJNVQHUPLMRIIGR-UHFFFAOYSA-N
XLogP4.41
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-aminopropyl)-N-ethyl-5-methylfuran-2-carboxamide
CID 43136432
5-methyl-N,N-bis(3-methylbutyl)furan-2-carboxamide
CID 112771490
5-bromo-N,N-dibutylfuran-2-carboxamide
CID 3627667
1-(5-methylfuran-2-yl)undecan-1-one
CID 114968847
N-(2-chloroethyl)-N-ethyl-5-methylfuran-2-carboxamide
CID 63395497
N-[(4-aminophenyl)methyl]-5-methyl-N-propylfuran-2-carboxamide
CID 43459468
4-ethyl-N,N-dihexylbenzamide
CID 533235
N-butyl-N-decylfuran-2-carboxamide
CID 91700689
5-amino-N,N-dipropylfuran-2-carboxamide
CID 82344196
N-butyl-N-decyl-4-ethylbenzamide
CID 91714679
N-(5-aminopentyl)-N,5-dimethylfuran-2-carboxamide
CID 107206681
2-methyl-N,N-dipentylbenzamide
CID 4576290

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N,N-dipentylfuran-2-carboxamide?
The IUPAC name of 5-methyl-N,N-dipentylfuran-2-carboxamide (CID 3319656) is 5-methyl-N,N-dipentylfuran-2-carboxamide.
What is the SMILES notation for 5-methyl-N,N-dipentylfuran-2-carboxamide?
The canonical SMILES for 5-methyl-N,N-dipentylfuran-2-carboxamide is CCCCCN(CCCCC)C(=O)c1ccc(C)o1.
What is the InChIKey of 5-methyl-N,N-dipentylfuran-2-carboxamide?
The InChIKey is JNVQHUPLMRIIGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-4-6-8-12-17(13-9-7-5-2)16(18)15-11-10-14(3)19-15/h10-11H,4-9,12-13H2,1-3H3.
What are the key properties of 5-methyl-N,N-dipentylfuran-2-carboxamide?
5-methyl-N,N-dipentylfuran-2-carboxamide has a molecular weight of 265.40 g/mol, XLogP of 4.41, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N,N-dipentylfuran-2-carboxamide is sourced from PubChem (CID 3319656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).