N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine

C42H41N — CID 54386971

IUPACN-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine
SMILESC(=C(c1ccccc1)c1ccc(C2CCCCC2)cc1)c1ccc(N(c2ccccc2)c2ccc3c(c2)CCCC3)cc1
InChIInChI=1S/C42H41N/c1-4-12-33(13-5-1)35-22-24-37(25-23-35)42(36-15-6-2-7-16-36)30-32-20-27-40(28-21-32)43(39-18-8-3-9-19-39)41-29-26-34-14-10-11-17-38(34)31-41/h2-3,6-9,15-16,18-31,33H,1,4-5,10-14,17H2
InChIKeyVDXSAFYGCZBUSZ-UHFFFAOYSA-N
MW559.80 g/mol
LogP11.67
Rot. Bonds7

About N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine

N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine (PubChem CID 54386971) has the molecular formula C42H41N and a molecular weight of 559.80 g/mol. Its IUPAC name is N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound NameN-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine
PubChem CID54386971
Molecular FormulaC42H41N
Molecular Weight559.80 g/mol
Exact Mass559.32
IUPAC NameN-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine
SMILESC(=C(c1ccccc1)c1ccc(C2CCCCC2)cc1)c1ccc(N(c2ccccc2)c2ccc3c(c2)CCCC3)cc1
InChIInChI=1S/C42H41N/c1-4-12-33(13-5-1)35-22-24-37(25-23-35)42(36-15-6-2-7-16-36)30-32-20-27-40(28-21-32)43(39-18-8-3-9-19-39)41-29-26-34-14-10-11-17-38(34)31-41/h2-3,6-9,15-16,18-31,33H,1,4-5,10-14,17H2
InChIKeyVDXSAFYGCZBUSZ-UHFFFAOYSA-N
XLogP11.67
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500559.80
LogP ≤ 511.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine with MolForge

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Related Compounds

N-[2-chloro-4-(2,2-diphenylethenyl)phenyl]-N-(4-cyclohexylphenyl)-5,6,7,8-tetrahydronaphthalen-1-amine
CID 15476324
N,N-diphenyl-4-[2-phenyl-2-[4-[1-phenyl-2-[4-(N-phenylanilino)phenyl]ethenyl]phenyl]ethenyl]aniline
CID 68997880
1,4-bis[(Z)-2-[4-[(Z)-2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]ethenyl]naphthalene
CID 148701620
4-[N-(5,6,7,8-tetrahydronaphthalen-2-yl)anilino]benzaldehyde
CID 19030131
N-[3-[2,2-bis(4-methylphenyl)ethenyl]phenyl]-N-[3-[(1E)-4,4-diphenylbuta-1,3-dienyl]phenyl]-5,6,7,8-tetrahydronaphthalen-2-amine
CID 89445655
N,N-bis[3-(4,4-diphenylbuta-1,3-dienyl)phenyl]-5,6,7,8-tetrahydronaphthalen-2-amine
CID 123935033
4-[4,4-bis(4-methylphenyl)buta-1,3-dienyl]-N-[4-(2,2-diphenylethenyl)phenyl]-N-(5,6,7,8-tetrahydronaphthalen-2-yl)naphthalen-1-amine
CID 123864125
N-[3-[2,2-bis(4-methylphenyl)ethenyl]phenyl]-N-[2-[(1E)-4,4-diphenylbuta-1,3-dienyl]phenyl]-5,6,7,8-tetrahydronaphthalen-2-amine;N-[4-[(1E)-4,4-diphenylbuta-1,3-dienyl]phenyl]-N-[3-(2,2-diphenylethenyl)phenyl]-5,6,7,8-tetrahydronaphthalen-2-amine
CID 159471400
N-[4-(2,2-diphenylethenyl)phenyl]-3-methyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-1-amine
CID 20762376
3-chloro-N-(4-cyclohexylphenyl)-N-phenylaniline
CID 177098600
4-[(E)-2-(4-cyclohexylphenyl)ethenyl]-N,N-bis[4-[(E)-2-(4-cyclohexylphenyl)ethenyl]phenyl]aniline
CID 59838926
[4-[(Z)-2-[4-[4-(hydroxymethyl)-N-[4-(hydroxymethyl)phenyl]anilino]phenyl]-1-phenylethenyl]phenyl]methanol
CID 146521934

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine?
The IUPAC name of N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine (CID 54386971) is N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine.
What is the SMILES notation for N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine?
The canonical SMILES for N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine is C(=C(c1ccccc1)c1ccc(C2CCCCC2)cc1)c1ccc(N(c2ccccc2)c2ccc3c(c2)CCCC3)cc1.
What is the InChIKey of N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine?
The InChIKey is VDXSAFYGCZBUSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H41N/c1-4-12-33(13-5-1)35-22-24-37(25-23-35)42(36-15-6-2-7-16-36)30-32-20-27-40(28-21-32)43(39-18-8-3-9-19-39)41-29-26-34-14-10-11-17-38(34)31-41/h2-3,6-9,15-16,18-31,33H,1,4-5,10-14,17H2.
What are the key properties of N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine?
N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine has a molecular weight of 559.80 g/mol, XLogP of 11.67, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(4-cyclohexylphenyl)-2-phenylethenyl]phenyl]-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 54386971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).