(Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine

C43H31NO — CID 142293824

IUPAC(Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine
SMILESN/C(=C\C(c1ccccc1)c1cccc(-c2cccc3c2oc2c4ccccc4ccc32)c1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C43H31NO/c44-41(33-23-21-30(22-24-33)29-11-3-1-4-12-29)28-40(31-13-5-2-6-14-31)35-17-9-16-34(27-35)37-19-10-20-38-39-26-25-32-15-7-8-18-36(32)42(39)45-43(37)38/h1-28,40H,44H2/b41-28-
InChIKeyFNINUBOVSFYCLP-DUJXHPOHSA-N
MW577.73 g/mol
LogP11.20
Rot. Bonds6

About (Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine

(Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine (PubChem CID 142293824) has the molecular formula C43H31NO and a molecular weight of 577.73 g/mol. Its IUPAC name is (Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine
PubChem CID142293824
Molecular FormulaC43H31NO
Molecular Weight577.73 g/mol
Exact Mass577.24
IUPAC Name(Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine
SMILESN/C(=C\C(c1ccccc1)c1cccc(-c2cccc3c2oc2c4ccccc4ccc32)c1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C43H31NO/c44-41(33-23-21-30(22-24-33)29-11-3-1-4-12-29)28-40(31-13-5-2-6-14-31)35-17-9-16-34(27-35)37-19-10-20-38-39-26-25-32-15-7-8-18-36(32)42(39)45-43(37)38/h1-28,40H,44H2/b41-28-
InChIKeyFNINUBOVSFYCLP-DUJXHPOHSA-N
XLogP11.20
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500577.73
LogP ≤ 511.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine
CID 142294020
10-(3-bromo-5-phenylphenyl)naphtho[1,2-b][1]benzofuran
CID 118616537
4-(4-phenylphenyl)-6-triphenylen-2-yldibenzofuran
CID 118651099
4-(3-phenanthro[1,2-b][1]benzofuran-10-yl-5-phenylphenyl)-2,6-diphenylpyrimidine
CID 171583610
N,N-bis(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-(3-phenylphenyl)aniline
CID 170272186
10-[3-[3-[(4-phenylphenyl)methyl]phenyl]phenyl]naphtho[1,2-b][1]benzofuran;toluene
CID 142294282
4-[3-[3-[naphthalen-1-yl-[4-(4-phenylphenyl)phenyl]methyl]phenyl]phenyl]dibenzofuran
CID 59136983
2,4-diphenyl-6-[8-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]-1,3,5-triazine
CID 171757132
2-[4-(3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4(9),5,7,11,14,16,18,20-decaen-5-yl)phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 139447245
10-[1,2,3,4,5,6,7,8-octadeuterio-10-(4-phenylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 171421116
2-[4-[7-(3-naphthalen-1-ylphenyl)naphtho[1,2-b][1]benzofuran-10-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 167424183
10-[9,9-dimethyl-7-(10-phenylanthracen-9-yl)fluoren-2-yl]naphtho[1,2-b][1]benzofuran
CID 122426066

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine?
The IUPAC name of (Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine (CID 142293824) is (Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine.
What is the SMILES notation for (Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine?
The canonical SMILES for (Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine is N/C(=C\C(c1ccccc1)c1cccc(-c2cccc3c2oc2c4ccccc4ccc32)c1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of (Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine?
The InChIKey is FNINUBOVSFYCLP-DUJXHPOHSA-N. The full InChI is InChI=1S/C43H31NO/c44-41(33-23-21-30(22-24-33)29-11-3-1-4-12-29)28-40(31-13-5-2-6-14-31)35-17-9-16-34(27-35)37-19-10-20-38-39-26-25-32-15-7-8-18-36(32)42(39)45-43(37)38/h1-28,40H,44H2/b41-28-.
What are the key properties of (Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine?
(Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine has a molecular weight of 577.73 g/mol, XLogP of 11.20, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(3-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-3-phenyl-1-(4-phenylphenyl)prop-1-en-1-amine is sourced from PubChem (CID 142293824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).