N,N-diethylfuran-3-amine

C8H13NO — CID 12009356

IUPACN,N-diethylfuran-3-amine
SMILESCCN(CC)c1ccoc1
InChIInChI=1S/C8H13NO/c1-3-9(4-2)8-5-6-10-7-8/h5-7H,3-4H2,1-2H3
InChIKeyLXMPLSIALAGOLD-UHFFFAOYSA-N
MW139.20 g/mol
LogP2.13
Rot. Bonds3

About N,N-diethylfuran-3-amine

N,N-diethylfuran-3-amine (PubChem CID 12009356) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is N,N-diethylfuran-3-amine.

Molecular Properties

Compound NameN,N-diethylfuran-3-amine
PubChem CID12009356
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC NameN,N-diethylfuran-3-amine
SMILESCCN(CC)c1ccoc1
InChIInChI=1S/C8H13NO/c1-3-9(4-2)8-5-6-10-7-8/h5-7H,3-4H2,1-2H3
InChIKeyLXMPLSIALAGOLD-UHFFFAOYSA-N
XLogP2.13
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 52.13
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-diethylfuran-3-amine?
The IUPAC name of N,N-diethylfuran-3-amine (CID 12009356) is N,N-diethylfuran-3-amine.
What is the SMILES notation for N,N-diethylfuran-3-amine?
The canonical SMILES for N,N-diethylfuran-3-amine is CCN(CC)c1ccoc1.
What is the InChIKey of N,N-diethylfuran-3-amine?
The InChIKey is LXMPLSIALAGOLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-3-9(4-2)8-5-6-10-7-8/h5-7H,3-4H2,1-2H3.
What are the key properties of N,N-diethylfuran-3-amine?
N,N-diethylfuran-3-amine has a molecular weight of 139.20 g/mol, XLogP of 2.13, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylfuran-3-amine is sourced from PubChem (CID 12009356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).