N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine

C34H37N — CID 167340397

IUPACN-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine
SMILESCC(C)(C)c1ccc(N(c2ccccc2)c2ccc3c(c2)C(C)(C)c2ccccc2C3(C)C)cc1
InChIInChI=1S/C34H37N/c1-32(2,3)24-17-19-26(20-18-24)35(25-13-9-8-10-14-25)27-21-22-30-31(23-27)34(6,7)29-16-12-11-15-28(29)33(30,4)5/h8-23H,1-7H3
InChIKeyJANDPBRXTQWFSX-UHFFFAOYSA-N
MW459.68 g/mol
LogP9.42
Rot. Bonds3

About N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine

N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine (PubChem CID 167340397) has the molecular formula C34H37N and a molecular weight of 459.68 g/mol. Its IUPAC name is N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine.

Molecular Properties

Compound NameN-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine
PubChem CID167340397
Molecular FormulaC34H37N
Molecular Weight459.68 g/mol
Exact Mass459.29
IUPAC NameN-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine
SMILESCC(C)(C)c1ccc(N(c2ccccc2)c2ccc3c(c2)C(C)(C)c2ccccc2C3(C)C)cc1
InChIInChI=1S/C34H37N/c1-32(2,3)24-17-19-26(20-18-24)35(25-13-9-8-10-14-25)27-21-22-30-31(23-27)34(6,7)29-16-12-11-15-28(29)33(30,4)5/h8-23H,1-7H3
InChIKeyJANDPBRXTQWFSX-UHFFFAOYSA-N
XLogP9.42
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500459.68
LogP ≤ 59.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-tert-butylphenyl)-9,9-dimethyl-N-phenylfluoren-3-amine
CID 167340405
N-[4-[(E)-2-[4-(N-(4-tert-butylphenyl)anilino)phenyl]ethenyl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
CID 89067846
9,9-dimethyl-N-phenyl-N-[4-[2-[4-(N-phenylanilino)phenyl]propan-2-yl]phenyl]fluoren-2-amine
CID 168810581
6-bromo-9,9,10,10-tetramethyl-N,N-diphenylanthracen-2-amine
CID 153445557
4-tert-butyl-N,N-diphenylaniline
CID 11312667
N-(5'-tert-butyl-12',12'-dimethylspiro[fluorene-9,8'-tetracyclo[7.5.0.02,7.011,13]tetradeca-1(14),2(7),3,5,9,11(13)-hexaene]-2-yl)-N-phenylspiro[fluorene-9,9'-xanthene]-2-amine
CID 118446636
N-[9,9-bis(4-tert-butylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9,9-bis(4-methylphenyl)fluoren-2-yl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-[9,9-bis(4-methylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9,9-bis(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 158846091
4-N,17-N-bis(4-tert-butylphenyl)-20,20-dimethyl-4-N,17-N-diphenylhexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine
CID 118360263
8,8,13,13-tetramethyl-5-N,5-N,16-N,16-N-tetraphenylhexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene-5,16-diamine
CID 59181773
9,9-dimethyl-N,N-diphenylfluoren-3-amine
CID 126704960
7-[(E)-2-[7-(N-(4-tert-butylphenyl)-4-methylanilino)-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethyl-N,N-diphenylfluoren-2-amine
CID 89068171
N-[3-[2-[4-[2-[3-(N-(9,9-dimethylfluoren-2-yl)anilino)phenyl]propan-2-yl]phenyl]propan-2-yl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 143493158

Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine?
The IUPAC name of N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine (CID 167340397) is N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine.
What is the SMILES notation for N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine?
The canonical SMILES for N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine is CC(C)(C)c1ccc(N(c2ccccc2)c2ccc3c(c2)C(C)(C)c2ccccc2C3(C)C)cc1.
What is the InChIKey of N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine?
The InChIKey is JANDPBRXTQWFSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H37N/c1-32(2,3)24-17-19-26(20-18-24)35(25-13-9-8-10-14-25)27-21-22-30-31(23-27)34(6,7)29-16-12-11-15-28(29)33(30,4)5/h8-23H,1-7H3.
What are the key properties of N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine?
N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine has a molecular weight of 459.68 g/mol, XLogP of 9.42, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butylphenyl)-9,9,10,10-tetramethyl-N-phenylanthracen-2-amine is sourced from PubChem (CID 167340397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).