(5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine

C16H14ClNO2 — CID 106684387

IUPAC(5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine
SMILESCOc1ccc2cc(C(N)c3ccc(Cl)o3)ccc2c1
InChIInChI=1S/C16H14ClNO2/c1-19-13-5-4-10-8-12(3-2-11(10)9-13)16(18)14-6-7-15(17)20-14/h2-9,16H,18H2,1H3
InChIKeySYCQXBJKWDOJGK-UHFFFAOYSA-N
MW287.75 g/mol
LogP4.14
Rot. Bonds3

About (5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine

(5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine (PubChem CID 106684387) has the molecular formula C16H14ClNO2 and a molecular weight of 287.75 g/mol. Its IUPAC name is (5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine.

Molecular Properties

Compound Name(5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine
PubChem CID106684387
Molecular FormulaC16H14ClNO2
Molecular Weight287.75 g/mol
Exact Mass287.07
IUPAC Name(5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine
SMILESCOc1ccc2cc(C(N)c3ccc(Cl)o3)ccc2c1
InChIInChI=1S/C16H14ClNO2/c1-19-13-5-4-10-8-12(3-2-11(10)9-13)16(18)14-6-7-15(17)20-14/h2-9,16H,18H2,1H3
InChIKeySYCQXBJKWDOJGK-UHFFFAOYSA-N
XLogP4.14
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.75
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-chlorophenyl)-(5-methoxy-1-benzofuran-2-yl)methanamine
CID 43826525
amino-(6-methoxynaphthalen-2-yl)methanol
CID 116939708
methoxy-(6-methoxynaphthalen-2-yl)methanamine
CID 116947369
(S)-(6-methoxynaphthalen-2-yl)-thiophen-2-ylmethanamine
CID 171199401
(S)-(6-methoxynaphthalen-2-yl)-[4-(trifluoromethoxy)phenyl]methanamine
CID 171239323
(2-bromofuran-3-yl)-(6-methoxynaphthalen-2-yl)methanamine
CID 106851764
1-(6-methoxynaphthalen-2-yl)propan-1-amine
CID 57010651
(R)-(6-methoxynaphthalen-2-yl)-thiophen-3-ylmethanamine;hydrochloride
CID 171218929
(1R)-1-(6-methoxynaphthalen-2-yl)ethane-1,2-diamine;hydrochloride
CID 171218891
(1S)-1-(6-methoxynaphthalen-2-yl)propan-1-amine;hydrochloride
CID 171218899
(3-bromo-4-ethoxyphenyl)-(5-chlorofuran-2-yl)methanamine
CID 106684609
methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate
CID 54022420

Frequently Asked Questions

What is the IUPAC name of (5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine?
The IUPAC name of (5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine (CID 106684387) is (5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine.
What is the SMILES notation for (5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine?
The canonical SMILES for (5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine is COc1ccc2cc(C(N)c3ccc(Cl)o3)ccc2c1.
What is the InChIKey of (5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine?
The InChIKey is SYCQXBJKWDOJGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClNO2/c1-19-13-5-4-10-8-12(3-2-11(10)9-13)16(18)14-6-7-15(17)20-14/h2-9,16H,18H2,1H3.
What are the key properties of (5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine?
(5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine has a molecular weight of 287.75 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chlorofuran-2-yl)-(6-methoxynaphthalen-2-yl)methanamine is sourced from PubChem (CID 106684387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).