2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine

C14H16ClNO2 — CID 113461713

IUPAC2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine
SMILESCOCc1ccc(C(N)Cc2ccc(Cl)cc2)o1
InChIInChI=1S/C14H16ClNO2/c1-17-9-12-6-7-14(18-12)13(16)8-10-2-4-11(15)5-3-10/h2-7,13H,8-9,16H2,1H3
InChIKeyFHIDLHZLHVDPKU-UHFFFAOYSA-N
MW265.74 g/mol
LogP3.32
Rot. Bonds5

About 2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine

2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine (PubChem CID 113461713) has the molecular formula C14H16ClNO2 and a molecular weight of 265.74 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine
PubChem CID113461713
Molecular FormulaC14H16ClNO2
Molecular Weight265.74 g/mol
Exact Mass265.09
IUPAC Name2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine
SMILESCOCc1ccc(C(N)Cc2ccc(Cl)cc2)o1
InChIInChI=1S/C14H16ClNO2/c1-17-9-12-6-7-14(18-12)13(16)8-10-2-4-11(15)5-3-10/h2-7,13H,8-9,16H2,1H3
InChIKeyFHIDLHZLHVDPKU-UHFFFAOYSA-N
XLogP3.32
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.74
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(methoxymethyl)furan-2-yl]ethane-1,2-diamine
CID 55273586
(5-chloro-2-iodophenyl)-[5-(methoxymethyl)furan-2-yl]methanamine
CID 114030695
2-(4-chlorophenyl)-1-(5-ethylfuran-2-yl)ethanol
CID 63895693
1-(7-chloro-1-benzofuran-2-yl)-2-(4-chlorophenyl)ethanamine
CID 114727608
2-cyclohexyl-1-[5-(methoxymethyl)furan-2-yl]ethanamine
CID 113461702
1-(5-chlorofuran-2-yl)-2-(4-iodophenyl)ethanamine
CID 106692144
1-(4-chlorophenyl)propan-2-amine
CID 3127
5-(methoxymethyl)furan-2-carbonyl chloride
CID 45081463
3-(4-chlorophenyl)-1,1-diethoxypropan-2-amine
CID 79496455
5-(methoxymethyl)furan-2-carbothioamide
CID 127005352
2-(4-chlorophenyl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethanamine
CID 114646649
methyl 5-(1-amino-2-phenylethyl)furan-2-carboxylate
CID 72983472

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine?
The IUPAC name of 2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine (CID 113461713) is 2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine.
What is the SMILES notation for 2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine?
The canonical SMILES for 2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine is COCc1ccc(C(N)Cc2ccc(Cl)cc2)o1.
What is the InChIKey of 2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine?
The InChIKey is FHIDLHZLHVDPKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClNO2/c1-17-9-12-6-7-14(18-12)13(16)8-10-2-4-11(15)5-3-10/h2-7,13H,8-9,16H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine?
2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine has a molecular weight of 265.74 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-1-[5-(methoxymethyl)furan-2-yl]ethanamine is sourced from PubChem (CID 113461713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).