N,N-dibutylfuran-3-amine

C12H21NO — CID 54003751

IUPACN,N-dibutylfuran-3-amine
SMILESCCCCN(CCCC)c1ccoc1
InChIInChI=1S/C12H21NO/c1-3-5-8-13(9-6-4-2)12-7-10-14-11-12/h7,10-11H,3-6,8-9H2,1-2H3
InChIKeyGAQGRIFITYUZRB-UHFFFAOYSA-N
MW195.31 g/mol
LogP3.69
Rot. Bonds7

About N,N-dibutylfuran-3-amine

N,N-dibutylfuran-3-amine (PubChem CID 54003751) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is N,N-dibutylfuran-3-amine.

Molecular Properties

Compound NameN,N-dibutylfuran-3-amine
PubChem CID54003751
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC NameN,N-dibutylfuran-3-amine
SMILESCCCCN(CCCC)c1ccoc1
InChIInChI=1S/C12H21NO/c1-3-5-8-13(9-6-4-2)12-7-10-14-11-12/h7,10-11H,3-6,8-9H2,1-2H3
InChIKeyGAQGRIFITYUZRB-UHFFFAOYSA-N
XLogP3.69
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-Acetamidofuran
CID 521882
Ammonium, (3-furyl)trimethyl-, iodide
CID 199990
4-(Furan-3-yl)morpholine
CID 12009355
3-Furylalanine
CID 22875442
3-Furylaminobutyric acid
CID 68798095
Furan-3-yl(trimethyl)azanium
CID 199991
N-(2-fluoroethyl)furan-3-amine
CID 140143628
N-(2,2-difluoroethyl)furan-3-amine
CID 151412690
1-(furan-3-yl)-3-(trifluoromethyl)-2H-imidazole
CID 174593433
4,4-Difluoro-1-(furan-3-yl)piperidine
CID 175988490
N-(furan-3-yl)pent-4-enamide
CID 11105709
ethyl N-(2-bromoprop-2-enyl)-N-(furan-3-yl)carbamate
CID 135076654

Frequently Asked Questions

What is the IUPAC name of N,N-dibutylfuran-3-amine?
The IUPAC name of N,N-dibutylfuran-3-amine (CID 54003751) is N,N-dibutylfuran-3-amine.
What is the SMILES notation for N,N-dibutylfuran-3-amine?
The canonical SMILES for N,N-dibutylfuran-3-amine is CCCCN(CCCC)c1ccoc1.
What is the InChIKey of N,N-dibutylfuran-3-amine?
The InChIKey is GAQGRIFITYUZRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c1-3-5-8-13(9-6-4-2)12-7-10-14-11-12/h7,10-11H,3-6,8-9H2,1-2H3.
What are the key properties of N,N-dibutylfuran-3-amine?
N,N-dibutylfuran-3-amine has a molecular weight of 195.31 g/mol, XLogP of 3.69, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutylfuran-3-amine is sourced from PubChem (CID 54003751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).