N,N-dibutyl-2-methylfuran-3-carboxamide

C14H23NO2 — CID 2165505

IUPACN,N-dibutyl-2-methylfuran-3-carboxamide
SMILESCCCCN(CCCC)C(=O)c1ccoc1C
InChIInChI=1S/C14H23NO2/c1-4-6-9-15(10-7-5-2)14(16)13-8-11-17-12(13)3/h8,11H,4-7,9-10H2,1-3H3
InChIKeyFEDWPTFGEULLGN-UHFFFAOYSA-N
MW237.34 g/mol
LogP3.63
Rot. Bonds7

About N,N-dibutyl-2-methylfuran-3-carboxamide

N,N-dibutyl-2-methylfuran-3-carboxamide (PubChem CID 2165505) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is N,N-dibutyl-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN,N-dibutyl-2-methylfuran-3-carboxamide
PubChem CID2165505
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC NameN,N-dibutyl-2-methylfuran-3-carboxamide
SMILESCCCCN(CCCC)C(=O)c1ccoc1C
InChIInChI=1S/C14H23NO2/c1-4-6-9-15(10-7-5-2)14(16)13-8-11-17-12(13)3/h8,11H,4-7,9-10H2,1-3H3
InChIKeyFEDWPTFGEULLGN-UHFFFAOYSA-N
XLogP3.63
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-2-methylfuran-3-carboxamide?
The IUPAC name of N,N-dibutyl-2-methylfuran-3-carboxamide (CID 2165505) is N,N-dibutyl-2-methylfuran-3-carboxamide.
What is the SMILES notation for N,N-dibutyl-2-methylfuran-3-carboxamide?
The canonical SMILES for N,N-dibutyl-2-methylfuran-3-carboxamide is CCCCN(CCCC)C(=O)c1ccoc1C.
What is the InChIKey of N,N-dibutyl-2-methylfuran-3-carboxamide?
The InChIKey is FEDWPTFGEULLGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-4-6-9-15(10-7-5-2)14(16)13-8-11-17-12(13)3/h8,11H,4-7,9-10H2,1-3H3.
What are the key properties of N,N-dibutyl-2-methylfuran-3-carboxamide?
N,N-dibutyl-2-methylfuran-3-carboxamide has a molecular weight of 237.34 g/mol, XLogP of 3.63, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-2-methylfuran-3-carboxamide is sourced from PubChem (CID 2165505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).