2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine

C12H12N2O — CID 130322183

IUPAC2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine
SMILESCc1c(N)c2c3ccccc3oc2n1C
InChIInChI=1S/C12H12N2O/c1-7-11(13)10-8-5-3-4-6-9(8)15-12(10)14(7)2/h3-6H,13H2,1-2H3
InChIKeyVRSQWCNVKYFJMR-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.82
Rot. Bonds

About 2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine

2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine (PubChem CID 130322183) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine.

Molecular Properties

Compound Name2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine
PubChem CID130322183
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine
SMILESCc1c(N)c2c3ccccc3oc2n1C
InChIInChI=1S/C12H12N2O/c1-7-11(13)10-8-5-3-4-6-9(8)15-12(10)14(7)2/h3-6H,13H2,1-2H3
InChIKeyVRSQWCNVKYFJMR-UHFFFAOYSA-N
XLogP2.82
TPSA44.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2,6-dimethylphenyl)-2-methyl-[1]benzofuro[2,3-b]pyrrol-1-amine
CID 130322189
1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine
CID 130322219
1,2,3-trimethyl-[1]benzofuro[2,3-c]pyrrole
CID 158099360
1-methylfuro[2,3-b][1]benzofuran-2-amine
CID 130322179
1,4-dimethylfuro[2,3-b]indol-2-amine
CID 130322177
dibenzofuran-1,2-diamine
CID 21425844
3-methyldibenzofuran-1,4-diamine
CID 68822096
2-([1]benzofuro[2,3-b]pyrrol-3-yl)-4,6-dimethylaniline
CID 156855302
11,23-dimethyl-9,21-dioxahexacyclo[11.11.0.02,10.03,8.014,22.015,20]tetracosa-1(13),2(10),3,5,7,11,14(22),15,17,19,23-undecaene
CID 144608278
1,3-di(propan-2-yl)dibenzofuran-4-amine
CID 58400957
2,4-di(propan-2-yl)dibenzofuran-1-amine;ethane
CID 144650095
2,3-dimethyl-1-benzofuran;ethane
CID 142047308

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine?
The IUPAC name of 2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine (CID 130322183) is 2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine.
What is the SMILES notation for 2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine?
The canonical SMILES for 2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine is Cc1c(N)c2c3ccccc3oc2n1C.
What is the InChIKey of 2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine?
The InChIKey is VRSQWCNVKYFJMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-7-11(13)10-8-5-3-4-6-9(8)15-12(10)14(7)2/h3-6H,13H2,1-2H3.
What are the key properties of 2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine?
2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine has a molecular weight of 200.24 g/mol, XLogP of 2.82, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine is sourced from PubChem (CID 130322183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).