1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine

C19H18N2O — CID 123784007

IUPAC1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine
SMILESCC=c1c(=CCC)n(N)c2ccc3oc4ccccc4c3c12
InChIInChI=1S/C19H18N2O/c1-3-7-14-12(4-2)18-15(21(14)20)10-11-17-19(18)13-8-5-6-9-16(13)22-17/h4-11H,3,20H2,1-2H3
InChIKeyCCZOXBKJRMFCBZ-UHFFFAOYSA-N
MW290.37 g/mol
LogP3.25
Rot. Bonds1

About 1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine

1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine (PubChem CID 123784007) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is 1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine.

Molecular Properties

Compound Name1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine
PubChem CID123784007
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine
SMILESCC=c1c(=CCC)n(N)c2ccc3oc4ccccc4c3c12
InChIInChI=1S/C19H18N2O/c1-3-7-14-12(4-2)18-15(21(14)20)10-11-17-19(18)13-8-5-6-9-16(13)22-17/h4-11H,3,20H2,1-2H3
InChIKeyCCZOXBKJRMFCBZ-UHFFFAOYSA-N
XLogP3.25
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 ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

14-ethyl-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 90350894
15,25-dioxa-10-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaen-10-amine
CID 146428559
(3Z)-2-methylidene-3-propylidene-1-benzofuran
CID 144554167
1-[10-(3-phenylphenyl)anthracen-9-yl]-[1]benzofuro[3,2-e][1]benzofuran
CID 176744543
5-[10-(9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaen-6-yl)anthracen-9-yl]-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;6-[10-(9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaen-6-yl)anthracen-9-yl]-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 159714513
9-phenyl-3-[10-(2-phenyl-[1]benzofuro[3,2-e][1]benzofuran-1-yl)anthracen-9-yl]carbazole
CID 176744439
dibenzofuran;ethanol
CID 174821059
6-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 122415742
11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1,3,5,7,10,12,14,16(24),18,20,22-undecaene
CID 164818106
2-[10-([1]benzofuro[3,2-e][1]benzofuran-1-yl)anthracen-9-yl]-9-phenylcarbazole
CID 176743582
6-[10-(2,6-diphenylphenyl)anthracen-9-yl]-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 171447365
1-(10-dibenzofuran-2-ylanthracen-9-yl)-2-phenyl-[1]benzofuro[3,2-e][1]benzofuran
CID 176744978

Frequently Asked Questions

What is the IUPAC name of 1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine?
The IUPAC name of 1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine (CID 123784007) is 1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine.
What is the SMILES notation for 1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine?
The canonical SMILES for 1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine is CC=c1c(=CCC)n(N)c2ccc3oc4ccccc4c3c12.
What is the InChIKey of 1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine?
The InChIKey is CCZOXBKJRMFCBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c1-3-7-14-12(4-2)18-15(21(14)20)10-11-17-19(18)13-8-5-6-9-16(13)22-17/h4-11H,3,20H2,1-2H3.
What are the key properties of 1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine?
1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine has a molecular weight of 290.37 g/mol, XLogP of 3.25, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethylidene-2-propylidene-[1]benzofuro[3,2-e]indol-3-amine is sourced from PubChem (CID 123784007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).