(4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine

C11H8ClNO2 — CID 115010192

IUPAC(4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine
SMILESNCc1c2ccoc2c(Cl)c2ccoc12
InChIInChI=1S/C11H8ClNO2/c12-9-7-2-4-14-10(7)8(5-13)6-1-3-15-11(6)9/h1-4H,5,13H2
InChIKeyXBWLHADMHZETRA-UHFFFAOYSA-N
MW221.64 g/mol
LogP3.29
Rot. Bonds1

About (4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine

(4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine (PubChem CID 115010192) has the molecular formula C11H8ClNO2 and a molecular weight of 221.64 g/mol. Its IUPAC name is (4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine.

Molecular Properties

Compound Name(4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine
PubChem CID115010192
Molecular FormulaC11H8ClNO2
Molecular Weight221.64 g/mol
Exact Mass221.02
IUPAC Name(4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine
SMILESNCc1c2ccoc2c(Cl)c2ccoc12
InChIInChI=1S/C11H8ClNO2/c12-9-7-2-4-14-10(7)8(5-13)6-1-3-15-11(6)9/h1-4H,5,13H2
InChIKeyXBWLHADMHZETRA-UHFFFAOYSA-N
XLogP3.29
TPSA52.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.64
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-chlorofuro[2,3-f][1]benzofuran-8-yl)butan-2-one
CID 115010227
[1-(4-chlorofuro[2,3-f][1]benzofuran-8-yl)cyclopentyl]methanamine
CID 117468018
[1-(4-chlorofuro[2,3-f][1]benzofuran-8-yl)cyclobutyl]methanamine
CID 117441417
4-(aminomethyl)-5-methyl-1-benzofuran-7-amine
CID 166848897
4-chlorofuro[2,3-f][1]benzofuran-8-carbaldehyde
CID 115010316
2-(4-chlorofuro[2,3-f][1]benzofuran-8-yl)propan-1-ol
CID 117380038
(4-chloro-1-benzofuran-5-yl)methanamine
CID 83817094
2-(4-methoxyfuro[2,3-f][1]benzofuran-8-yl)ethanamine
CID 117333887
(5,7-dimethyl-1-benzofuran-4-yl)methanamine;5,7-dimethyl-4-propan-2-yl-1-benzofuran;ethane
CID 156724956
(7-chloro-2-methyl-1-benzofuran-3-yl)methanamine
CID 83907915
3-(4-chlorofuro[2,3-f][1]benzofuran-8-yl)-1H-pyrazole-5-carboxylic acid
CID 117487490
2-amino-1-(4-chloro-7-methoxy-1-benzofuran-5-yl)ethanone
CID 117351723

Frequently Asked Questions

What is the IUPAC name of (4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine?
The IUPAC name of (4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine (CID 115010192) is (4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine.
What is the SMILES notation for (4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine?
The canonical SMILES for (4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine is NCc1c2ccoc2c(Cl)c2ccoc12.
What is the InChIKey of (4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine?
The InChIKey is XBWLHADMHZETRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClNO2/c12-9-7-2-4-14-10(7)8(5-13)6-1-3-15-11(6)9/h1-4H,5,13H2.
What are the key properties of (4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine?
(4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine has a molecular weight of 221.64 g/mol, XLogP of 3.29, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorofuro[2,3-f][1]benzofuran-8-yl)methanamine is sourced from PubChem (CID 115010192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).