N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine

C56H42N2 — CID 89074309

IUPACN,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine
SMILESC=C1c2cccc3c2N2c4c1cc(-c1ccc5cc(N(c6cccc7ccccc67)c6cccc7ccccc67)ccc5c1)cc4C(C)(C)c1cccc(c12)C3(C)C
InChIInChI=1S/C56H42N2/c1-34-42-20-12-21-46-52(42)58-53-45(34)32-40(33-49(53)56(4,5)48-23-13-22-47(54(48)58)55(46,2)3)38-26-27-39-31-41(29-28-37(39)30-38)57(50-24-10-16-35-14-6-8-18-43(35)50)51-25-11-17-36-15-7-9-19-44(36)51/h6-33H,1H2,2-5H3
InChIKeyRKFNAYPQJWOBDL-UHFFFAOYSA-N
MW742.97 g/mol
LogP15.41
Rot. Bonds4

About N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine

N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine (PubChem CID 89074309) has the molecular formula C56H42N2 and a molecular weight of 742.97 g/mol. Its IUPAC name is N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine.

Molecular Properties

Compound NameN,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine
PubChem CID89074309
Molecular FormulaC56H42N2
Molecular Weight742.97 g/mol
Exact Mass742.33
IUPAC NameN,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine
SMILESC=C1c2cccc3c2N2c4c1cc(-c1ccc5cc(N(c6cccc7ccccc67)c6cccc7ccccc67)ccc5c1)cc4C(C)(C)c1cccc(c12)C3(C)C
InChIInChI=1S/C56H42N2/c1-34-42-20-12-21-46-52(42)58-53-45(34)32-40(33-49(53)56(4,5)48-23-13-22-47(54(48)58)55(46,2)3)38-26-27-39-31-41(29-28-37(39)30-38)57(50-24-10-16-35-14-6-8-18-43(35)50)51-25-11-17-36-15-7-9-19-44(36)51/h6-33H,1H2,2-5H3
InChIKeyRKFNAYPQJWOBDL-UHFFFAOYSA-N
XLogP15.41
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500742.97
LogP ≤ 515.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine with MolForge

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Related Compounds

N-[4-(8,8,14,14,22,22-hexamethyl-11-phenyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)phenyl]-N-phenylnaphthalen-1-amine
CID 70885924
6-[(16E,18Z)-5-[6-(dinaphthalen-1-ylamino)naphthalen-2-yl]-8,8,14,14,22,22-hexamethyl-20-methylidene-1-azapentacyclo[11.7.1.13,19.02,7.09,21]docosa-2(7),3,5,9,11,13(21),16,18-octaen-17-yl]-N,N-dinaphthalen-1-ylnaphthalen-2-amine
CID 89074525
4-methyl-N-(4-methylphenyl)-N-[4-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)phenyl]aniline
CID 89074322
8,8,14,14-tetramethyl-22-methylidene-N-phenyl-N-(4-phenylphenyl)-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-amine
CID 89065349
4-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)-N-naphthalen-1-yl-N-phenylnaphthalen-1-amine
CID 70885891
8,8,14,14-tetramethyl-N-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaen-5-amine
CID 70892813
N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-1-ylfluoren-1-amine;N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-9,9-dimethyl-N-naphthalen-2-ylfluoren-1-amine;N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-1-amine
CID 159322510
8,8,14,14,22,22-hexamethyl-5,11-dinaphthalen-2-yl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene
CID 70892958
8,8,14,14-tetramethyl-N,N-dinaphthalen-1-yl-11-phenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaen-5-amine
CID 70893017
N-[4-[4-[bis(9,9-dimethylfluoren-2-yl)amino]phenyl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-2-N,7-N-diphenylfluorene-2,7-diamine;N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)anilino)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]fluoren-2-amine;N-[4-[4-(N-(4-naphthalen-2-ylphenyl)-4-phenylanilino)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;2-N,2-N,7-N,7-N-tetrakis(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene-2,7-diamine
CID 162201655
N-(4-naphthalen-2-ylphenyl)-N-(4-phenylphenyl)-5-(8,8,14,14-tetramethyl-5,17-diphenyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-11-yl)naphthalen-1-amine
CID 90201402
N-naphthalen-2-yl-N-phenyl-5-(8,8,14,14-tetramethyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine
CID 70893250

Frequently Asked Questions

What is the IUPAC name of N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine?
The IUPAC name of N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine (CID 89074309) is N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine.
What is the SMILES notation for N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine?
The canonical SMILES for N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine is C=C1c2cccc3c2N2c4c1cc(-c1ccc5cc(N(c6cccc7ccccc67)c6cccc7ccccc67)ccc5c1)cc4C(C)(C)c1cccc(c12)C3(C)C.
What is the InChIKey of N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine?
The InChIKey is RKFNAYPQJWOBDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H42N2/c1-34-42-20-12-21-46-52(42)58-53-45(34)32-40(33-49(53)56(4,5)48-23-13-22-47(54(48)58)55(46,2)3)38-26-27-39-31-41(29-28-37(39)30-38)57(50-24-10-16-35-14-6-8-18-43(35)50)51-25-11-17-36-15-7-9-19-44(36)51/h6-33H,1H2,2-5H3.
What are the key properties of N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine?
N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine has a molecular weight of 742.97 g/mol, XLogP of 15.41, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dinaphthalen-1-yl-6-(8,8,14,14-tetramethyl-22-methylidene-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine is sourced from PubChem (CID 89074309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).