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

C12H12N2O — CID 130322219

IUPAC1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine
SMILESCc1c(N)c2oc3ccccc3c2n1C
InChIInChI=1S/C12H12N2O/c1-7-10(13)12-11(14(7)2)8-5-3-4-6-9(8)15-12/h3-6H,13H2,1-2H3
InChIKeyQMQKYNOLUHBSKI-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.82
Rot. Bonds

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

1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine (PubChem CID 130322219) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine.

Molecular Properties

Compound Name1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine
PubChem CID130322219
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine
SMILESCc1c(N)c2oc3ccccc3c2n1C
InChIInChI=1S/C12H12N2O/c1-7-10(13)12-11(14(7)2)8-5-3-4-6-9(8)15-12/h3-6H,13H2,1-2H3
InChIKeyQMQKYNOLUHBSKI-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

1,2-dimethyl-3-phenyl-[1]benzofuro[3,2-b]pyrrole
CID 157483251
2,3-dimethyl-[1]benzofuro[2,3-b]pyrrol-1-amine
CID 130322183
1,2,3-trimethyl-[1]benzofuro[2,3-c]pyrrole
CID 158099360
15-methyl-8,11-dioxa-15-azatetracyclo[7.6.0.02,7.010,14]pentadeca-1(9),2,4,6,10(14),12-hexaene
CID 118370842
3-methyldibenzofuran-1,4-diamine
CID 68822096
11-phenyl-3,19-dioxa-11-azapentacyclo[10.7.0.02,10.04,9.013,18]nonadeca-1(12),2(10),4,6,8,13,15,17-octaene
CID 143805499
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-methyl-3-(2-phenylethyl)-[1]benzofuro[3,2-d]pyrimidine-2,4-dione
CID 155977216
1,3-di(propan-2-yl)dibenzofuran-4-amine
CID 58400957
2-methyl-[1]benzofuro[3,2-d]pyrimidin-3-ium-4-amine chloride
CID 135958604
29-methyl-9-oxa-1,29-diazaoctacyclo[13.12.1.120,23.02,10.03,8.011,28.016,21.022,27]nonacosa-2(10),3,5,7,11,13,15(28),16(21),17,19,22,24,26-tridecaene
CID 163436695
1,2-dimethylchromeno[3,4-d]imidazol-4-one
CID 773639

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine?
The IUPAC name of 1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine (CID 130322219) is 1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine.
What is the SMILES notation for 1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine?
The canonical SMILES for 1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine is Cc1c(N)c2oc3ccccc3c2n1C.
What is the InChIKey of 1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine?
The InChIKey is QMQKYNOLUHBSKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-7-10(13)12-11(14(7)2)8-5-3-4-6-9(8)15-12/h3-6H,13H2,1-2H3.
What are the key properties of 1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine?
1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-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 1,2-dimethyl-[1]benzofuro[3,2-b]pyrrol-3-amine is sourced from PubChem (CID 130322219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).