1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine

C18H15NOS — CID 63424251

IUPAC1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine
SMILESCNCc1csc(-c2ccc3oc4ccccc4c3c2)c1
InChIInChI=1S/C18H15NOS/c1-19-10-12-8-18(21-11-12)13-6-7-17-15(9-13)14-4-2-3-5-16(14)20-17/h2-9,11,19H,10H2,1H3
InChIKeyWFMAXZKCGIWOKJ-UHFFFAOYSA-N
MW293.39 g/mol
LogP5.03
Rot. Bonds3

About 1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine

1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine (PubChem CID 63424251) has the molecular formula C18H15NOS and a molecular weight of 293.39 g/mol. Its IUPAC name is 1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine
PubChem CID63424251
Molecular FormulaC18H15NOS
Molecular Weight293.39 g/mol
Exact Mass293.09
IUPAC Name1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine
SMILESCNCc1csc(-c2ccc3oc4ccccc4c3c2)c1
InChIInChI=1S/C18H15NOS/c1-19-10-12-8-18(21-11-12)13-6-7-17-15(9-13)14-4-2-3-5-16(14)20-17/h2-9,11,19H,10H2,1H3
InChIKeyWFMAXZKCGIWOKJ-UHFFFAOYSA-N
XLogP5.03
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.39
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(2-fluorophenyl)thiophen-3-yl]-N-methylmethanamine
CID 62491192
2-[4-[7-(4-ethylphenyl)naphthalen-2-yl]phenyl]dibenzofuran
CID 170293807
CID 90291993
CID 90291993
2-(10-dibenzofuran-3-ylanthracen-9-yl)dibenzofuran
CID 135208637
10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4,6,8,11,14,16,18-nonaene;ethane
CID 154692122
N-(dibenzofuran-2-ylmethyl)propan-1-amine
CID 19048253
6-[8-(3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaen-7-yl)dibenzofuran-2-yl]-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaene
CID 142487676
2,4-di(dibenzofuran-2-yl)-6-dibenzofuran-3-ylpyrimidine
CID 138736794
1-(dibenzofuran-3-ylmethyl)-2-methylhydrazine;hydrochloride
CID 159122805
5-dibenzofuran-2-yl-N,3-dimethylpentan-1-amine
CID 65304674
2-[4-[(4-dibenzofuran-4-ylphenyl)methyl]phenyl]dibenzofuran
CID 159612507
2-[3-dibenzofuran-2-yl-5-[7-[3,5-di(dibenzofuran-2-yl)phenyl]triphenylen-2-yl]phenyl]dibenzofuran
CID 118490746

Frequently Asked Questions

What is the IUPAC name of 1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine (CID 63424251) is 1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine is CNCc1csc(-c2ccc3oc4ccccc4c3c2)c1.
What is the InChIKey of 1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine?
The InChIKey is WFMAXZKCGIWOKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NOS/c1-19-10-12-8-18(21-11-12)13-6-7-17-15(9-13)14-4-2-3-5-16(14)20-17/h2-9,11,19H,10H2,1H3.
What are the key properties of 1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine?
1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine has a molecular weight of 293.39 g/mol, XLogP of 5.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-dibenzofuran-2-ylthiophen-3-yl)-N-methylmethanamine is sourced from PubChem (CID 63424251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).