N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide

C18H21FN2O2 — CID 119614985

IUPACN-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
SMILESNCC(NC(=O)CCc1ccc(-c2ccccc2F)o1)C1CC1
InChIInChI=1S/C18H21FN2O2/c19-15-4-2-1-3-14(15)17-9-7-13(23-17)8-10-18(22)21-16(11-20)12-5-6-12/h1-4,7,9,12,16H,5-6,8,10-11,20H2,(H,21,22)
InChIKeyZXIILKQPLKOGQB-UHFFFAOYSA-N
MW316.38 g/mol
LogP2.87
Rot. Bonds7

About N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide

N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide (PubChem CID 119614985) has the molecular formula C18H21FN2O2 and a molecular weight of 316.38 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
PubChem CID119614985
Molecular FormulaC18H21FN2O2
Molecular Weight316.38 g/mol
Exact Mass316.16
IUPAC NameN-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
SMILESNCC(NC(=O)CCc1ccc(-c2ccccc2F)o1)C1CC1
InChIInChI=1S/C18H21FN2O2/c19-15-4-2-1-3-14(15)17-9-7-13(23-17)8-10-18(22)21-16(11-20)12-5-6-12/h1-4,7,9,12,16H,5-6,8,10-11,20H2,(H,21,22)
InChIKeyZXIILKQPLKOGQB-UHFFFAOYSA-N
XLogP2.87
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-1-cyclopropylethyl)-5-(2-fluorophenyl)furan-2-carboxamide;hydrochloride
CID 119613475
N-cyclopropyl-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 17419085
N-cyclohexyl-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 9243405
N-[2-(cyclopropylamino)-2-oxoethyl]-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 18163857
4-[3-[5-(2-fluorophenyl)furan-2-yl]propanoylamino]cyclohexane-1-carboxylic acid
CID 119229769
2-[5-(2-fluorophenyl)furan-2-yl]ethanamine
CID 54775832
N-(2-acetamidoethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 30598254
N-(3-aminobutyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 119496957
N-(1-amino-2,3-dimethylbutan-2-yl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide;hydrochloride
CID 119607048
3-[5-(2-fluorophenyl)furan-2-yl]-N-[2-(methylamino)propyl]propanamide;hydrochloride
CID 120827866
4-[3-[5-(2-fluorophenyl)furan-2-yl]propanoylamino]benzamide
CID 17430904
3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-methylpiperidin-4-yl)propanamide
CID 120600684

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide (CID 119614985) is N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide is NCC(NC(=O)CCc1ccc(-c2ccccc2F)o1)C1CC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide?
The InChIKey is ZXIILKQPLKOGQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2O2/c19-15-4-2-1-3-14(15)17-9-7-13(23-17)8-10-18(22)21-16(11-20)12-5-6-12/h1-4,7,9,12,16H,5-6,8,10-11,20H2,(H,21,22).
What are the key properties of N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide?
N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide has a molecular weight of 316.38 g/mol, XLogP of 2.87, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide is sourced from PubChem (CID 119614985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).