N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine

C26H37N — CID 163675892

IUPACN-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine
SMILESCc1cc(C(C)(C)C)cc(C)c1N(C)c1ccc2c(c1)C(C)(C)CC2(C)C
InChIInChI=1S/C26H37N/c1-17-13-19(24(3,4)5)14-18(2)23(17)27(10)20-11-12-21-22(15-20)26(8,9)16-25(21,6)7/h11-15H,16H2,1-10H3
InChIKeyWBKKXPJJICRICU-UHFFFAOYSA-N
MW363.59 g/mol
LogP7.33
Rot. Bonds2

About N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine

N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine (PubChem CID 163675892) has the molecular formula C26H37N and a molecular weight of 363.59 g/mol. Its IUPAC name is N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine.

Molecular Properties

Compound NameN-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine
PubChem CID163675892
Molecular FormulaC26H37N
Molecular Weight363.59 g/mol
Exact Mass363.29
IUPAC NameN-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine
SMILESCc1cc(C(C)(C)C)cc(C)c1N(C)c1ccc2c(c1)C(C)(C)CC2(C)C
InChIInChI=1S/C26H37N/c1-17-13-19(24(3,4)5)14-18(2)23(17)27(10)20-11-12-21-22(15-20)26(8,9)16-25(21,6)7/h11-15H,16H2,1-10H3
InChIKeyWBKKXPJJICRICU-UHFFFAOYSA-N
XLogP7.33
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.59
LogP ≤ 57.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine
CID 163675888
N-(3-chloro-5-methylphenyl)-N,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-amine
CID 166879527
6-[3-tert-butyl-5-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
CID 170942414
N,N-bis(4-bromophenyl)-4-methyl-3-(1,1,3,3-tetramethyl-2H-inden-5-yl)aniline
CID 142500443
N-(4-tert-butylphenyl)-5,5,7,7,21,21,23,23-octamethyl-N-(2-methylphenyl)-11,17-bis(1,1,3,3-tetramethyl-2H-inden-5-yl)-11,17-diaza-1-boraheptacyclo[14.10.1.02,10.04,8.012,27.018,26.020,24]heptacosa-2,4(8),9,12,14,16(27),18,20(24),25-nonaen-14-amine
CID 166497464
1,1,3,3-tetramethyl-N-(1,1,3,3-tetramethyl-2H-inden-5-yl)-2H-inden-5-amine
CID 154972054
6-tert-butyl-3-(2,2-dimethylpropyl)-1,1,3,4-tetramethyl-2H-indene
CID 615183
N-(4-tert-butyl-2-methylphenyl)-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-amine
CID 155595921
3-N-[5-(6-tert-butyl-4a,9a-dimethyl-1,2,3,4-tetrahydrocarbazol-9-yl)-2-methylphenyl]-2,5-dimethyl-1-N,3-N-bis(1,1,3,3,6-pentamethyl-2H-inden-5-yl)-1-N-(1,1,3,3-tetramethyl-2H-inden-5-yl)benzene-1,3-diamine
CID 167394661
5,11-ditert-butyl-18,18,20,20-tetramethyl-8-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-14-(1,1,3,3-tetramethyl-2H-inden-5-yl)-8,14-diaza-1-borahexacyclo[11.10.1.02,7.09,24.015,23.017,21]tetracosa-2(7),3,5,9,11,13(24),15,17(21),22-nonaene
CID 167394123
1-(1,1,3,3-tetramethyl-2H-inden-5-yl)ethanol
CID 20543027
ethane;propane;1,1,3,3-tetramethyl-2H-inden-5-ol
CID 142016467

Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine?
The IUPAC name of N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine (CID 163675892) is N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine.
What is the SMILES notation for N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine?
The canonical SMILES for N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine is Cc1cc(C(C)(C)C)cc(C)c1N(C)c1ccc2c(c1)C(C)(C)CC2(C)C.
What is the InChIKey of N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine?
The InChIKey is WBKKXPJJICRICU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H37N/c1-17-13-19(24(3,4)5)14-18(2)23(17)27(10)20-11-12-21-22(15-20)26(8,9)16-25(21,6)7/h11-15H,16H2,1-10H3.
What are the key properties of N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine?
N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine has a molecular weight of 363.59 g/mol, XLogP of 7.33, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine is sourced from PubChem (CID 163675892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).