N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine

C115H90N4 — CID 162082331

IUPACN-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine
SMILESCC(C)(C)c1ccc(Nc2ccc3ccccc3c2)cc1.CC1(C)c2ccccc2-c2ccc(Nc3ccc4ccccc4c3)cc21.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(Nc4ccc5ccccc5c4)cc32)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(Nc3ccc4ccccc4c3)cc21
InChIInChI=1S/C35H23N.C35H25N.C25H21N.C20H21N/c1-2-10-24-21-25(18-17-23(24)9-1)36-26-19-20-30-29-13-5-8-16-33(29)35(34(30)22-26)31-14-6-3-11-27(31)28-12-4-7-15-32(28)35;1-3-13-27(14-4-1)35(28-15-5-2-6-16-28)33-18-10-9-17-31(33)32-22-21-30(24-34(32)35)36-29-20-19-25-11-7-8-12-26(25)23-29;1-25(2)23-10-6-5-9-21(23)22-14-13-20(16-24(22)25)26-19-12-11-17-7-3-4-8-18(17)15-19;1-20(2,3)17-9-12-18(13-10-17)21-19-11-8-15-6-4-5-7-16(15)14-19/h1-22,36H;1-24,36H;3-16,26H,1-2H3;4-14,21H,1-3H3
InChIKeyZCMRWGBMNQAPLM-UHFFFAOYSA-N
MW1528.01 g/mol
LogP30.64
Rot. Bonds10

About N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine

N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine (PubChem CID 162082331) has the molecular formula C115H90N4 and a molecular weight of 1528.01 g/mol. Its IUPAC name is N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine.

Molecular Properties

Compound NameN-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine
PubChem CID162082331
Molecular FormulaC115H90N4
Molecular Weight1528.01 g/mol
Exact Mass1526.72
IUPAC NameN-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine
SMILESCC(C)(C)c1ccc(Nc2ccc3ccccc3c2)cc1.CC1(C)c2ccccc2-c2ccc(Nc3ccc4ccccc4c3)cc21.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(Nc4ccc5ccccc5c4)cc32)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(Nc3ccc4ccccc4c3)cc21
InChIInChI=1S/C35H23N.C35H25N.C25H21N.C20H21N/c1-2-10-24-21-25(18-17-23(24)9-1)36-26-19-20-30-29-13-5-8-16-33(29)35(34(30)22-26)31-14-6-3-11-27(31)28-12-4-7-15-32(28)35;1-3-13-27(14-4-1)35(28-15-5-2-6-16-28)33-18-10-9-17-31(33)32-22-21-30(24-34(32)35)36-29-20-19-25-11-7-8-12-26(25)23-29;1-25(2)23-10-6-5-9-21(23)22-14-13-20(16-24(22)25)26-19-12-11-17-7-3-4-8-18(17)15-19;1-20(2,3)17-9-12-18(13-10-17)21-19-11-8-15-6-4-5-7-16(15)14-19/h1-22,36H;1-24,36H;3-16,26H,1-2H3;4-14,21H,1-3H3
InChIKeyZCMRWGBMNQAPLM-UHFFFAOYSA-N
XLogP30.64
TPSA48.12 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms119
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001528.01
LogP ≤ 530.64
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine with MolForge

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Related Compounds

4-tert-butyl-N-(4-tert-butylphenyl)aniline;4-tert-butyl-N-(4-methoxyphenyl)aniline;N-(4-methoxyphenyl)-9,9-dimethylfluoren-2-amine;N-(4-methoxyphenyl)-9,9-diphenylfluoren-2-amine;N-(4-methoxyphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 161077645
N-(4-tert-butylphenyl)naphthalen-1-amine;9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine;N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-1-yl-9,9'-spirobi[fluorene]-2-amine
CID 157367101
9,9-bis(4-tert-butylphenyl)-N-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoren-2-amine
CID 177114050
9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine
CID 58453890
N-[4-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]phenyl]-9,9-diphenylfluoren-2-amine
CID 177113841
9,9-dimethyl-N-[4-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]phenyl]fluoren-2-amine
CID 177113997
2-methylprop-1-ene;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine
CID 145077293
N-(4-tert-butylphenyl)pyridin-2-amine;9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-(4-methoxyphenyl)pyridin-2-amine;N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-pyridin-2-ylpyridin-2-amine
CID 161255688
N-[3-(9-phenylfluoren-9-yl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 138519337
N-(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-2-amine
CID 121423904
N-(9,9-dimethylfluoren-2-yl)-9,9,10,10-tetramethylanthracen-2-amine
CID 166647046
1-N,4-N-bis(9,9'-spirobi[fluorene]-2-yl)benzene-1,4-diamine
CID 122468678

Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine?
The IUPAC name of N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine (CID 162082331) is N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine.
What is the SMILES notation for N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine?
The canonical SMILES for N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine is CC(C)(C)c1ccc(Nc2ccc3ccccc3c2)cc1.CC1(C)c2ccccc2-c2ccc(Nc3ccc4ccccc4c3)cc21.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(Nc4ccc5ccccc5c4)cc32)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(Nc3ccc4ccccc4c3)cc21.
What is the InChIKey of N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine?
The InChIKey is ZCMRWGBMNQAPLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H23N.C35H25N.C25H21N.C20H21N/c1-2-10-24-21-25(18-17-23(24)9-1)36-26-19-20-30-29-13-5-8-16-33(29)35(34(30)22-26)31-14-6-3-11-27(31)28-12-4-7-15-32(28)35;1-3-13-27(14-4-1)35(28-15-5-2-6-16-28)33-18-10-9-17-31(33)32-22-21-30(24-34(32)35)36-29-20-19-25-11-7-8-12-26(25)23-29;1-25(2)23-10-6-5-9-21(23)22-14-13-20(16-24(22)25)26-19-12-11-17-7-3-4-8-18(17)15-19;1-20(2,3)17-9-12-18(13-10-17)21-19-11-8-15-6-4-5-7-16(15)14-19/h1-22,36H;1-24,36H;3-16,26H,1-2H3;4-14,21H,1-3H3.
What are the key properties of N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine?
N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine has a molecular weight of 1528.01 g/mol, XLogP of 30.64, 10 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butylphenyl)naphthalen-2-amine;9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine;N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine;N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine is sourced from PubChem (CID 162082331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).