5-(2-aminobutyl)-N,N-dimethylfuran-2-amine

C10H18N2O — CID 170889541

IUPAC5-(2-aminobutyl)-N,N-dimethylfuran-2-amine
SMILESCCC(N)Cc1ccc(N(C)C)o1
InChIInChI=1S/C10H18N2O/c1-4-8(11)7-9-5-6-10(13-9)12(2)3/h5-6,8H,4,7,11H2,1-3H3
InChIKeyLWDFXULIWDMVHB-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.63
Rot. Bonds4

About 5-(2-aminobutyl)-N,N-dimethylfuran-2-amine

5-(2-aminobutyl)-N,N-dimethylfuran-2-amine (PubChem CID 170889541) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 5-(2-aminobutyl)-N,N-dimethylfuran-2-amine.

Molecular Properties

Compound Name5-(2-aminobutyl)-N,N-dimethylfuran-2-amine
PubChem CID170889541
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name5-(2-aminobutyl)-N,N-dimethylfuran-2-amine
SMILESCCC(N)Cc1ccc(N(C)C)o1
InChIInChI=1S/C10H18N2O/c1-4-8(11)7-9-5-6-10(13-9)12(2)3/h5-6,8H,4,7,11H2,1-3H3
InChIKeyLWDFXULIWDMVHB-UHFFFAOYSA-N
XLogP1.63
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-3-[5-(dimethylamino)furan-2-yl]propanoic acid
CID 129366758
[5-(2-aminobutyl)furan-2-yl]methanol
CID 170888411
5-(aminomethyl)-N,N-dimethylfuran-2-amine
CID 82418188
5-(2-aminoethyl)-N,N-dimethylfuran-2-amine
CID 55253433
1-[5-(3,4-dichlorophenyl)furan-2-yl]butan-2-amine
CID 170889125
1-[5-(3-chloro-4-methoxyphenyl)furan-2-yl]butan-2-amine
CID 170889123
1-[5-[2-(trifluoromethyl)phenyl]furan-2-yl]butan-2-amine;hydrochloride
CID 170889105
1-[5-(1H-1,2,4-triazol-5-ylsulfanyl)furan-2-yl]butan-2-amine
CID 170889850
1-[5-(2-aminobutyl)thiophen-2-yl]butan-2-amine;hydrochloride
CID 170888988
1-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]butan-2-amine
CID 170889110
N-[2-(2-aminobutyl)phenyl]-N,2-dimethylaniline
CID 63816863
N'-[2-(2-aminobutyl)phenyl]-N,N,N'-trimethylethane-1,2-diamine
CID 63795925

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminobutyl)-N,N-dimethylfuran-2-amine?
The IUPAC name of 5-(2-aminobutyl)-N,N-dimethylfuran-2-amine (CID 170889541) is 5-(2-aminobutyl)-N,N-dimethylfuran-2-amine.
What is the SMILES notation for 5-(2-aminobutyl)-N,N-dimethylfuran-2-amine?
The canonical SMILES for 5-(2-aminobutyl)-N,N-dimethylfuran-2-amine is CCC(N)Cc1ccc(N(C)C)o1.
What is the InChIKey of 5-(2-aminobutyl)-N,N-dimethylfuran-2-amine?
The InChIKey is LWDFXULIWDMVHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-4-8(11)7-9-5-6-10(13-9)12(2)3/h5-6,8H,4,7,11H2,1-3H3.
What are the key properties of 5-(2-aminobutyl)-N,N-dimethylfuran-2-amine?
5-(2-aminobutyl)-N,N-dimethylfuran-2-amine has a molecular weight of 182.27 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminobutyl)-N,N-dimethylfuran-2-amine is sourced from PubChem (CID 170889541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).