(Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one

C140H118N4O8 — CID 160624686

IUPAC(Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one
SMILESCO/C(C)=C(\C(C)=O)c1c2ccccc2c(N(c2ccccc2)c2ccccc2-c2ccccc2)c2ccccc12.CO/C(C)=C(\C(C)=O)c1ccc2cc(N(c3ccccc3)c3ccccc3-c3ccccc3)ccc2c1.CO/C(C)=C(\C(C)=O)c1ccc2ccc(N(c3ccccc3)c3ccccc3-c3ccccc3)cc2c1.CO/C(C)=C(\C(C)=O)c1cccc2c(N(c3ccccc3)c3ccccc3-c3ccccc3)cccc12
InChIInChI=1S/C38H31NO2.3C34H29NO2/c1-26(40)36(27(2)41-3)37-31-21-10-12-23-33(31)38(34-24-13-11-22-32(34)37)39(29-18-8-5-9-19-29)35-25-15-14-20-30(35)28-16-6-4-7-17-28;1-24(36)34(25(2)37-3)31-21-12-20-30-29(31)19-13-23-33(30)35(27-16-8-5-9-17-27)32-22-11-10-18-28(32)26-14-6-4-7-15-26;1-24(36)34(25(2)37-3)28-19-18-26-20-21-31(23-29(26)22-28)35(30-14-8-5-9-15-30)33-17-11-10-16-32(33)27-12-6-4-7-13-27;1-24(36)34(25(2)37-3)29-19-18-28-23-31(21-20-27(28)22-29)35(30-14-8-5-9-15-30)33-17-11-10-16-32(33)26-12-6-4-7-13-26/h4-25H,1-3H3;3*4-23H,1-3H3/b36-27+;3*34-25+
InChIKeyRHDKGONCBXUELD-ZRMPXZMRSA-N
MW1984.50 g/mol
LogP36.93
Rot. Bonds28

About (Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one

(Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one (PubChem CID 160624686) has the molecular formula C140H118N4O8 and a molecular weight of 1984.50 g/mol. Its IUPAC name is (Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one.

Molecular Properties

Compound Name(Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one
PubChem CID160624686
Molecular FormulaC140H118N4O8
Molecular Weight1984.50 g/mol
Exact Mass1982.89
IUPAC Name(Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one
SMILESCO/C(C)=C(\C(C)=O)c1c2ccccc2c(N(c2ccccc2)c2ccccc2-c2ccccc2)c2ccccc12.CO/C(C)=C(\C(C)=O)c1ccc2cc(N(c3ccccc3)c3ccccc3-c3ccccc3)ccc2c1.CO/C(C)=C(\C(C)=O)c1ccc2ccc(N(c3ccccc3)c3ccccc3-c3ccccc3)cc2c1.CO/C(C)=C(\C(C)=O)c1cccc2c(N(c3ccccc3)c3ccccc3-c3ccccc3)cccc12
InChIInChI=1S/C38H31NO2.3C34H29NO2/c1-26(40)36(27(2)41-3)37-31-21-10-12-23-33(31)38(34-24-13-11-22-32(34)37)39(29-18-8-5-9-19-29)35-25-15-14-20-30(35)28-16-6-4-7-17-28;1-24(36)34(25(2)37-3)31-21-12-20-30-29(31)19-13-23-33(30)35(27-16-8-5-9-17-27)32-22-11-10-18-28(32)26-14-6-4-7-15-26;1-24(36)34(25(2)37-3)28-19-18-26-20-21-31(23-29(26)22-28)35(30-14-8-5-9-15-30)33-17-11-10-16-32(33)27-12-6-4-7-13-27;1-24(36)34(25(2)37-3)29-19-18-28-23-31(21-20-27(28)22-29)35(30-14-8-5-9-15-30)33-17-11-10-16-32(33)26-12-6-4-7-13-26/h4-25H,1-3H3;3*4-23H,1-3H3/b36-27+;3*34-25+
InChIKeyRHDKGONCBXUELD-ZRMPXZMRSA-N
XLogP36.93
TPSA118.16 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds28
Heavy Atoms152
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001984.50
LogP ≤ 536.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze (Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z)-4-methoxy-3-[4-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[4-(N-(2-phenylphenyl)anilino)phenyl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(4-phenylphenyl)anilino)pyren-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[2,3,5,6-tetramethyl-4-(N-(2-phenylphenyl)anilino)phenyl]pent-3-en-2-one
CID 160954089
(Z)-3-[10-(N-(9,9-dimethylfluoren-2-yl)anilino)anthracen-9-yl]-4-methoxypent-3-en-2-one;(Z)-3-[12-(N-(9,9-dimethylfluoren-2-yl)anilino)chrysen-6-yl]-4-methoxypent-3-en-2-one;(Z)-3-[6-(N-(9,9-dimethylfluoren-2-yl)anilino)naphthalen-2-yl]-4-methoxypent-3-en-2-one;(Z)-3-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)naphthalen-2-yl]-4-methoxypent-3-en-2-one
CID 160713415
(Z)-4-methoxy-3-[4-(4-phenyl-N-(4-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]pent-3-en-2-one;(Z)-4-methoxy-3-[2,3,5,6-tetramethyl-4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]pent-3-en-2-one
CID 159912190
6-[(E)-2-naphthalen-2-yl-1,2-diphenylethenyl]-N,N-bis(2-phenylphenyl)naphthalen-2-amine
CID 58667645
N-naphthalen-2-yl-N-(4-phenanthren-9-ylphenyl)phenanthren-9-amine;N-(4-phenanthren-9-ylphenyl)-N-(2-phenylphenyl)phenanthren-9-amine;N-(4-phenanthren-9-ylphenyl)-N-(3-phenylphenyl)phenanthren-9-amine;N-(4-phenanthren-9-ylphenyl)-N-(4-phenylphenyl)phenanthren-9-amine
CID 163909892
N,2-diphenyl-N-[4-[3-[3-[4-(N-(2-phenylphenyl)anilino)phenyl]phenyl]phenyl]phenyl]aniline;N,3-diphenyl-N-[4-[3-[3-[4-(N-(3-phenylphenyl)anilino)phenyl]phenyl]phenyl]phenyl]aniline;N-[4-[3-[3-[4-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine;N-phenyl-N-(4-phenylphenyl)-3-[3-[3-[3-(N-(4-phenylphenyl)anilino)phenyl]phenyl]phenyl]aniline
CID 158453384
N-[3-(3-chrysen-6-ylphenyl)phenyl]-N-(2-phenylphenyl)naphthalen-2-amine
CID 170141177
N,N-diphenylaniline;N,N-diphenylnaphthalen-1-amine;N,N-diphenylnaphthalen-2-amine;ethane;N-naphthalen-1-yl-N-phenylnaphthalen-1-amine;N-naphthalen-1-yl-N-phenylnaphthalen-2-amine;N-naphthalen-2-yl-N-phenylnaphthalen-2-amine
CID 161430896
1-N,3-N-dinaphthalen-1-yl-1-N,3-N,4,6-tetraphenylbenzene-1,3-diamine;4,6-diphenyl-1-N,1-N,3-N,3-N-tetrakis(4-phenylphenyl)benzene-1,3-diamine;3-N-naphthalen-1-yl-1-N,1-N,3-N,4,6-pentakis-phenylbenzene-1,3-diamine;3-N-naphthalen-2-yl-1-N,1-N,3-N,4,6-pentakis-phenylbenzene-1,3-diamine
CID 159990110
N-naphthalen-2-yl-N-(2-phenylphenyl)chrysen-6-amine
CID 170135515
2-N,4-N-bis(3-naphthalen-2-ylphenyl)-2-N,4-N-diphenylphenanthrene-2,4-diamine;2-N,4-N-bis(4-naphthalen-1-ylphenyl)-2-N,4-N-diphenylphenanthrene-2,4-diamine;2-N,4-N-bis(4-naphthalen-2-ylphenyl)-2-N,4-N-diphenylphenanthrene-2,4-diamine;2-N,4-N-dinaphthalen-2-yl-2-N,4-N-diphenylphenanthrene-2,4-diamine;2-N,4-N-diphenyl-2-N,4-N-bis(2-phenylphenyl)phenanthrene-2,4-diamine;2-N,4-N-diphenyl-2-N,4-N-bis(3-phenylphenyl)phenanthrene-2,4-diamine;2-N,4-N-diphenyl-2-N,4-N-bis(4-phenylphenyl)phenanthrene-2,4-diamine;2-N,2-N,4-N,4-N-tetraphenylphenanthrene-2,4-diamine
CID 163819030
9-N-naphthalen-2-yl-9-N,21-N-diphenyl-21-N-(2-phenylphenyl)-12,18-dioxa-1-boraheptacyclo[15.11.1.02,11.03,8.013,29.019,28.022,27]nonacosa-2(11),3,5,7,9,13(29),14,16,19(28),20,22,24,26-tridecaene-9,21-diamine
CID 153312338

Frequently Asked Questions

What is the IUPAC name of (Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one?
The IUPAC name of (Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one (CID 160624686) is (Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one.
What is the SMILES notation for (Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one?
The canonical SMILES for (Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one is CO/C(C)=C(\C(C)=O)c1c2ccccc2c(N(c2ccccc2)c2ccccc2-c2ccccc2)c2ccccc12.CO/C(C)=C(\C(C)=O)c1ccc2cc(N(c3ccccc3)c3ccccc3-c3ccccc3)ccc2c1.CO/C(C)=C(\C(C)=O)c1ccc2ccc(N(c3ccccc3)c3ccccc3-c3ccccc3)cc2c1.CO/C(C)=C(\C(C)=O)c1cccc2c(N(c3ccccc3)c3ccccc3-c3ccccc3)cccc12.
What is the InChIKey of (Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one?
The InChIKey is RHDKGONCBXUELD-ZRMPXZMRSA-N. The full InChI is InChI=1S/C38H31NO2.3C34H29NO2/c1-26(40)36(27(2)41-3)37-31-21-10-12-23-33(31)38(34-24-13-11-22-32(34)37)39(29-18-8-5-9-19-29)35-25-15-14-20-30(35)28-16-6-4-7-17-28;1-24(36)34(25(2)37-3)31-21-12-20-30-29(31)19-13-23-33(30)35(27-16-8-5-9-17-27)32-22-11-10-18-28(32)26-14-6-4-7-15-26;1-24(36)34(25(2)37-3)28-19-18-26-20-21-31(23-29(26)22-28)35(30-14-8-5-9-15-30)33-17-11-10-16-32(33)27-12-6-4-7-13-27;1-24(36)34(25(2)37-3)29-19-18-28-23-31(21-20-27(28)22-29)35(30-14-8-5-9-15-30)33-17-11-10-16-32(33)26-12-6-4-7-13-26/h4-25H,1-3H3;3*4-23H,1-3H3/b36-27+;3*34-25+.
What are the key properties of (Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one?
(Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one has a molecular weight of 1984.50 g/mol, XLogP of 36.93, 28 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-methoxy-3-[10-(N-(2-phenylphenyl)anilino)anthracen-9-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[5-(N-(2-phenylphenyl)anilino)naphthalen-1-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[6-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one;(Z)-4-methoxy-3-[7-(N-(2-phenylphenyl)anilino)naphthalen-2-yl]pent-3-en-2-one is sourced from PubChem (CID 160624686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).