4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine

C19H18N2O — CID 130322518

IUPAC4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine
SMILESCc1cccc(C)c1-n1c2ccccc2c2oc(C)c(N)c21
InChIInChI=1S/C19H18N2O/c1-11-7-6-8-12(2)17(11)21-15-10-5-4-9-14(15)19-18(21)16(20)13(3)22-19/h4-10H,20H2,1-3H3
InChIKeyLOKGDGXHMHTIKE-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.88
Rot. Bonds1

About 4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine

4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine (PubChem CID 130322518) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is 4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine.

Molecular Properties

Compound Name4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine
PubChem CID130322518
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine
SMILESCc1cccc(C)c1-n1c2ccccc2c2oc(C)c(N)c21
InChIInChI=1S/C19H18N2O/c1-11-7-6-8-12(2)17(11)21-15-10-5-4-9-14(15)19-18(21)16(20)13(3)22-19/h4-10H,20H2,1-3H3
InChIKeyLOKGDGXHMHTIKE-UHFFFAOYSA-N
XLogP4.88
TPSA44.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine?
The IUPAC name of 4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine (CID 130322518) is 4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine.
What is the SMILES notation for 4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine?
The canonical SMILES for 4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine is Cc1cccc(C)c1-n1c2ccccc2c2oc(C)c(N)c21.
What is the InChIKey of 4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine?
The InChIKey is LOKGDGXHMHTIKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c1-11-7-6-8-12(2)17(11)21-15-10-5-4-9-14(15)19-18(21)16(20)13(3)22-19/h4-10H,20H2,1-3H3.
What are the key properties of 4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine?
4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine has a molecular weight of 290.37 g/mol, XLogP of 4.88, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine is sourced from PubChem (CID 130322518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).