(5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine

C14H16ClNO2 — CID 55061748

IUPAC(5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine
SMILESCCc1ccc(C(N)c2cc(Cl)ccc2OC)o1
InChIInChI=1S/C14H16ClNO2/c1-3-10-5-7-13(18-10)14(16)11-8-9(15)4-6-12(11)17-2/h4-8,14H,3,16H2,1-2H3
InChIKeyGNJUTAQLSICCLB-UHFFFAOYSA-N
MW265.74 g/mol
LogP3.55
Rot. Bonds4

About (5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine

(5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine (PubChem CID 55061748) has the molecular formula C14H16ClNO2 and a molecular weight of 265.74 g/mol. Its IUPAC name is (5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine.

Molecular Properties

Compound Name(5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine
PubChem CID55061748
Molecular FormulaC14H16ClNO2
Molecular Weight265.74 g/mol
Exact Mass265.09
IUPAC Name(5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine
SMILESCCc1ccc(C(N)c2cc(Cl)ccc2OC)o1
InChIInChI=1S/C14H16ClNO2/c1-3-10-5-7-13(18-10)14(16)11-8-9(15)4-6-12(11)17-2/h4-8,14H,3,16H2,1-2H3
InChIKeyGNJUTAQLSICCLB-UHFFFAOYSA-N
XLogP3.55
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.74
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-chloro-2-methoxyphenyl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
CID 62346399
3-amino-2-(5-chloro-2-methoxyphenyl)-1-(5-ethylfuran-2-yl)propan-1-ol
CID 79086034
(5-chloro-2-methoxyphenyl)-(2-methoxyphenyl)methanamine
CID 55116277
(5-chloro-2-iodophenyl)-[5-(methoxymethyl)furan-2-yl]methanamine
CID 114030695
(4-chloro-2,5-difluorophenyl)-(5-ethylfuran-2-yl)methanamine
CID 82783479
(1R)-1-(5-chloro-2-methoxyphenyl)propan-1-amine;hydrochloride
CID 171215023
(5-ethylfuran-2-yl)-(4-methoxy-2-methylphenyl)methanamine
CID 79094304
(5-chloro-2-methoxyphenyl)-(2-fluoro-3-methoxyphenyl)methanamine
CID 105024912
(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclopropyl)methanamine
CID 107001396
2-(5-chloro-2-methoxyphenyl)-3-(5-ethylfuran-2-yl)-3-oxopropanenitrile
CID 79095982
(5-chloro-2-methoxyphenyl)-(1H-1,2,4-triazol-5-yl)methanamine
CID 65362666
2-chloro-1-(5-chloro-2-methoxyphenyl)ethanamine
CID 116937510

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine?
The IUPAC name of (5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine (CID 55061748) is (5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine.
What is the SMILES notation for (5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine?
The canonical SMILES for (5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine is CCc1ccc(C(N)c2cc(Cl)ccc2OC)o1.
What is the InChIKey of (5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine?
The InChIKey is GNJUTAQLSICCLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClNO2/c1-3-10-5-7-13(18-10)14(16)11-8-9(15)4-6-12(11)17-2/h4-8,14H,3,16H2,1-2H3.
What are the key properties of (5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine?
(5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine has a molecular weight of 265.74 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-methoxyphenyl)-(5-ethylfuran-2-yl)methanamine is sourced from PubChem (CID 55061748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).