benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene

C137H110N2 — CID 161127822

IUPACbenzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene
SMILESc1ccc(-c2ccc(Cc3ccc4ccccc4c3)cc2)cc1.c1ccc(-c2cccc(Cc3cccc(-c4ccccc4)c3)c2)cc1.c1ccc(Cc2cccc(-c3ccccc3)c2)cc1.c1ccc(Cc2ccccc2)cc1.c1ccc(Nc2cccc3ccccc23)cc1.c1ccc2c(Nc3cccc4ccccc34)cccc2c1.c1ccc2cc(Cc3ccc4ccccc4c3)ccc2c1
InChIInChI=1S/C25H20.C23H18.C21H16.C20H15N.C19H16.C16H13N.C13H12/c1-3-11-22(12-4-1)24-15-7-9-20(18-24)17-21-10-8-16-25(19-21)23-13-5-2-6-14-23;1-2-6-20(7-3-1)22-13-10-18(11-14-22)16-19-12-15-21-8-4-5-9-23(21)17-19;1-3-7-20-14-16(9-11-18(20)5-1)13-17-10-12-19-6-2-4-8-21(19)15-17;1-3-11-17-15(7-1)9-5-13-19(17)21-20-14-6-10-16-8-2-4-12-18(16)20;1-3-8-16(9-4-1)14-17-10-7-13-19(15-17)18-11-5-2-6-12-18;1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16;1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1-16,18-19H,17H2;1-15,17H,16H2;1-12,14-15H,13H2;1-14,21H;1-13,15H,14H2;1-12,17H;1-10H,11H2
InChIKeyULUCQCQCLOHLSP-UHFFFAOYSA-N
MW1784.40 g/mol
LogP36.83
Rot. Bonds18

About benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene

benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene (PubChem CID 161127822) has the molecular formula C137H110N2 and a molecular weight of 1784.40 g/mol. Its IUPAC name is benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene.

Molecular Properties

Compound Namebenzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene
PubChem CID161127822
Molecular FormulaC137H110N2
Molecular Weight1784.40 g/mol
Exact Mass1782.87
IUPAC Namebenzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene
SMILESc1ccc(-c2ccc(Cc3ccc4ccccc4c3)cc2)cc1.c1ccc(-c2cccc(Cc3cccc(-c4ccccc4)c3)c2)cc1.c1ccc(Cc2cccc(-c3ccccc3)c2)cc1.c1ccc(Cc2ccccc2)cc1.c1ccc(Nc2cccc3ccccc23)cc1.c1ccc2c(Nc3cccc4ccccc34)cccc2c1.c1ccc2cc(Cc3ccc4ccccc4c3)ccc2c1
InChIInChI=1S/C25H20.C23H18.C21H16.C20H15N.C19H16.C16H13N.C13H12/c1-3-11-22(12-4-1)24-15-7-9-20(18-24)17-21-10-8-16-25(19-21)23-13-5-2-6-14-23;1-2-6-20(7-3-1)22-13-10-18(11-14-22)16-19-12-15-21-8-4-5-9-23(21)17-19;1-3-7-20-14-16(9-11-18(20)5-1)13-17-10-12-19-6-2-4-8-21(19)15-17;1-3-11-17-15(7-1)9-5-13-19(17)21-20-14-6-10-16-8-2-4-12-18(16)20;1-3-8-16(9-4-1)14-17-10-7-13-19(15-17)18-11-5-2-6-12-18;1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16;1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1-16,18-19H,17H2;1-15,17H,16H2;1-12,14-15H,13H2;1-14,21H;1-13,15H,14H2;1-12,17H;1-10H,11H2
InChIKeyULUCQCQCLOHLSP-UHFFFAOYSA-N
XLogP36.83
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds18
Heavy Atoms139
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001784.40
LogP ≤ 536.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene with MolForge

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Related Compounds

N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine
CID 58672315
benzylbenzene;ethane;bis(N-phenylnaphthalen-1-amine)
CID 157375605
N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 59029878
2-(naphthalen-1-ylmethyl)-9,9-diphenylfluorene;1-(naphthalen-2-ylmethyl)naphthalene;2-[(4-phenylphenyl)methyl]-9,9'-spirobi[fluorene];N-(4-phenylphenyl)naphthalen-1-amine;N,9,9-triphenylfluoren-2-amine
CID 158247118
2-[(3-benzylphenyl)methyl]naphthalene
CID 157208363
1,4-bis(3-benzylphenyl)benzene
CID 175442136
2-benzylnaphthalene
CID 11948
N-(2,5-diphenylphenyl)naphthalen-1-amine
CID 174398533
N-naphthalen-1-ylnaphthalen-1-amine;N-naphthalen-1-ylnaphthalen-2-amine;N-naphthalen-1-ylpyridin-2-amine;N-(4-phenylphenyl)naphthalen-1-amine
CID 158790277
2-[(4-tert-butylphenyl)methyl]phenanthrene;1-[4-[(3,5-diphenylphenyl)methyl]phenyl]naphthalene;1,3-diphenyl-5-[(4-phenylphenyl)methyl]benzene;1-[4-(naphthalen-2-ylmethyl)phenyl]naphthalene;1-[3-[(3-naphthalen-1-ylphenyl)methyl]phenyl]naphthalene;1-[4-[(3-phenylphenyl)methyl]phenyl]naphthalene
CID 160912130
2-naphthalen-2-yl-N-[4-[4-(2-naphthalen-1-ylanilino)phenyl]phenyl]aniline
CID 69101182
N-[4-[[4-(pentacen-1-ylamino)phenyl]methyl]phenyl]pentacen-1-amine
CID 134716564

Frequently Asked Questions

What is the IUPAC name of benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene?
The IUPAC name of benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene (CID 161127822) is benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene.
What is the SMILES notation for benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene?
The canonical SMILES for benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene is c1ccc(-c2ccc(Cc3ccc4ccccc4c3)cc2)cc1.c1ccc(-c2cccc(Cc3cccc(-c4ccccc4)c3)c2)cc1.c1ccc(Cc2cccc(-c3ccccc3)c2)cc1.c1ccc(Cc2ccccc2)cc1.c1ccc(Nc2cccc3ccccc23)cc1.c1ccc2c(Nc3cccc4ccccc34)cccc2c1.c1ccc2cc(Cc3ccc4ccccc4c3)ccc2c1.
What is the InChIKey of benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene?
The InChIKey is ULUCQCQCLOHLSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20.C23H18.C21H16.C20H15N.C19H16.C16H13N.C13H12/c1-3-11-22(12-4-1)24-15-7-9-20(18-24)17-21-10-8-16-25(19-21)23-13-5-2-6-14-23;1-2-6-20(7-3-1)22-13-10-18(11-14-22)16-19-12-15-21-8-4-5-9-23(21)17-19;1-3-7-20-14-16(9-11-18(20)5-1)13-17-10-12-19-6-2-4-8-21(19)15-17;1-3-11-17-15(7-1)9-5-13-19(17)21-20-14-6-10-16-8-2-4-12-18(16)20;1-3-8-16(9-4-1)14-17-10-7-13-19(15-17)18-11-5-2-6-12-18;1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16;1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1-16,18-19H,17H2;1-15,17H,16H2;1-12,14-15H,13H2;1-14,21H;1-13,15H,14H2;1-12,17H;1-10H,11H2.
What are the key properties of benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene?
benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene has a molecular weight of 1784.40 g/mol, XLogP of 36.83, 18 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzylbenzene;1-benzyl-3-phenylbenzene;2-(naphthalen-2-ylmethyl)naphthalene;N-naphthalen-1-ylnaphthalen-1-amine;N-phenylnaphthalen-1-amine;2-[(4-phenylphenyl)methyl]naphthalene;1-phenyl-3-[(3-phenylphenyl)methyl]benzene is sourced from PubChem (CID 161127822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).