3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine

C15H19NO2 — CID 82542723

IUPAC3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine
SMILESCOc1ccccc1-c1ccc(C(C)CCN)o1
InChIInChI=1S/C15H19NO2/c1-11(9-10-16)13-7-8-15(18-13)12-5-3-4-6-14(12)17-2/h3-8,11H,9-10,16H2,1-2H3
InChIKeyHNUYBJWUEJPVLZ-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.41
Rot. Bonds5

About 3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine

3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine (PubChem CID 82542723) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine.

Molecular Properties

Compound Name3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine
PubChem CID82542723
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine
SMILESCOc1ccccc1-c1ccc(C(C)CCN)o1
InChIInChI=1S/C15H19NO2/c1-11(9-10-16)13-7-8-15(18-13)12-5-3-4-6-14(12)17-2/h3-8,11H,9-10,16H2,1-2H3
InChIKeyHNUYBJWUEJPVLZ-UHFFFAOYSA-N
XLogP3.41
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[5-(2-methoxyphenyl)-3-pyridinyl]butan-1-amine
CID 82542720
3-[5-(3,5-dichlorophenyl)furan-2-yl]butan-1-amine
CID 82542304
3-[5-(3-chlorophenyl)furan-2-yl]butan-1-amine
CID 82542677
5-(4-aminobutan-2-yl)-4-(2-methoxyphenyl)-N-methyl-1,3-thiazol-2-amine
CID 82542709
2-(2-methoxyphenyl)-5-(4-methoxyphenyl)furan
CID 132514365
5-[4-(2-methoxyphenyl)phenyl]-3-methylpentan-1-amine
CID 82542712
(1S)-1-(2-methoxyphenyl)propane-1,3-diamine
CID 171219974
3-[5-(3,4-dichlorophenyl)furan-2-yl]butan-1-amine
CID 82542294
4-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pentan-1-amine
CID 104685789
3-(2-methoxyphenyl)sulfanylbutan-1-amine
CID 61291883
3-(2-ethoxy-6-methoxyphenyl)butan-1-amine
CID 117320562
1-[5-[2-(methoxymethyl)phenyl]furan-2-yl]ethanol
CID 62499246

Frequently Asked Questions

What is the IUPAC name of 3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine?
The IUPAC name of 3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine (CID 82542723) is 3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine.
What is the SMILES notation for 3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine?
The canonical SMILES for 3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine is COc1ccccc1-c1ccc(C(C)CCN)o1.
What is the InChIKey of 3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine?
The InChIKey is HNUYBJWUEJPVLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-11(9-10-16)13-7-8-15(18-13)12-5-3-4-6-14(12)17-2/h3-8,11H,9-10,16H2,1-2H3.
What are the key properties of 3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine?
3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine has a molecular weight of 245.32 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(2-methoxyphenyl)furan-2-yl]butan-1-amine is sourced from PubChem (CID 82542723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).