(Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine

C20H20N2O2 — CID 170113170

IUPAC(Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine
SMILESCC(C)N(C)/C=C\Nc1cccc2c1oc1c3ccccc3oc21
InChIInChI=1S/C20H20N2O2/c1-13(2)22(3)12-11-21-16-9-6-8-15-18(16)24-19-14-7-4-5-10-17(14)23-20(15)19/h4-13,21H,1-3H3/b12-11-
InChIKeyZLJTYGGAGWIACO-QXMHVHEDSA-N
MW320.39 g/mol
LogP5.56
Rot. Bonds4

About (Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine

(Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine (PubChem CID 170113170) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is (Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine.

Molecular Properties

Compound Name(Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine
PubChem CID170113170
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name(Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine
SMILESCC(C)N(C)/C=C\Nc1cccc2c1oc1c3ccccc3oc21
InChIInChI=1S/C20H20N2O2/c1-13(2)22(3)12-11-21-16-9-6-8-15-18(16)24-19-14-7-4-5-10-17(14)23-20(15)19/h4-13,21H,1-3H3/b12-11-
InChIKeyZLJTYGGAGWIACO-QXMHVHEDSA-N
XLogP5.56
TPSA41.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.39
LogP ≤ 55.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine with MolForge

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Related Compounds

N-[(1Z,3Z)-3-methylpenta-1,3-dienyl]dibenzofuran-4-amine
CID 145027861
N-[(1Z,3Z)-3-methylhexa-1,3-dienyl]dibenzofuran-4-amine
CID 145212273
ethane;N-[(1Z,3E)-3-(4-methylphenyl)penta-1,3-dienyl]dibenzofuran-4-amine
CID 145027907
N-(2-methylbutyl)dibenzofuran-4-amine
CID 167309390
N-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran-10-amine
CID 168804074
N-dibenzofuran-1-yldibenzofuran-4-amine
CID 138484831
1-(1-dibenzofuran-4-ylethyl)-1-hydroxyurea
CID 21293764
N-[4-[4-(dibenzofuran-4-ylamino)phenyl]phenyl]dibenzofuran-4-amine
CID 172539034
N-dibenzofuran-4-ylpropanamide
CID 138533625
N-methyldibenzofuran-1-amine
CID 135277683
N-[(3,5-dimethoxyphenyl)methyl]dibenzofuran-4-amine
CID 22664094
N-(2-fluorophenyl)-N-methyldibenzofuran-4-amine
CID 134527943

Frequently Asked Questions

What is the IUPAC name of (Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine?
The IUPAC name of (Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine (CID 170113170) is (Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine.
What is the SMILES notation for (Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine?
The canonical SMILES for (Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine is CC(C)N(C)/C=C\Nc1cccc2c1oc1c3ccccc3oc21.
What is the InChIKey of (Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine?
The InChIKey is ZLJTYGGAGWIACO-QXMHVHEDSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-13(2)22(3)12-11-21-16-9-6-8-15-18(16)24-19-14-7-4-5-10-17(14)23-20(15)19/h4-13,21H,1-3H3/b12-11-.
What are the key properties of (Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine?
(Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine has a molecular weight of 320.39 g/mol, XLogP of 5.56, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-([1]benzofuro[3,2-b][1]benzofuran-1-yl)-N'-methyl-N'-propan-2-ylethene-1,2-diamine is sourced from PubChem (CID 170113170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).