N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine

C50H38N2 — CID 70885823

IUPACN-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine
SMILESCC1(C)c2cccc3c2-n2c4c1cccc4c1cc(-c4ccc(N(c5ccccc5)c5ccc6ccccc6c5)c5ccccc45)cc(c12)C3(C)C
InChIInChI=1S/C50H38N2/c1-49(2)41-21-12-20-39-40-29-33(30-44-47(40)52(46(39)41)48-42(49)22-13-23-43(48)50(44,3)4)36-26-27-45(38-19-11-10-18-37(36)38)51(34-16-6-5-7-17-34)35-25-24-31-14-8-9-15-32(31)28-35/h5-30H,1-4H3
InChIKeyBSOHUSWJSUDMDR-UHFFFAOYSA-N
MW666.87 g/mol
LogP13.51
Rot. Bonds4

About N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine

N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine (PubChem CID 70885823) has the molecular formula C50H38N2 and a molecular weight of 666.87 g/mol. Its IUPAC name is N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine.

Molecular Properties

Compound NameN-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine
PubChem CID70885823
Molecular FormulaC50H38N2
Molecular Weight666.87 g/mol
Exact Mass666.30
IUPAC NameN-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine
SMILESCC1(C)c2cccc3c2-n2c4c1cccc4c1cc(-c4ccc(N(c5ccccc5)c5ccc6ccccc6c5)c5ccccc45)cc(c12)C3(C)C
InChIInChI=1S/C50H38N2/c1-49(2)41-21-12-20-39-40-29-33(30-44-47(40)52(46(39)41)48-42(49)22-13-23-43(48)50(44,3)4)36-26-27-45(38-19-11-10-18-37(36)38)51(34-16-6-5-7-17-34)35-25-24-31-14-8-9-15-32(31)28-35/h5-30H,1-4H3
InChIKeyBSOHUSWJSUDMDR-UHFFFAOYSA-N
XLogP13.51
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500666.87
LogP ≤ 513.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-yl]fluoren-2-amine
CID 70885833
N,N-diphenyl-6-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-2-amine
CID 70893180
4-[17-[4-(4-tert-butyl-N-(4-tert-butylphenyl)anilino)naphthalen-1-yl]-8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9(21),10,12,15,17,19-nonaen-5-yl]-N,N-bis(4-tert-butylphenyl)naphthalen-1-amine
CID 89074513
8,8,14,14-tetramethyl-N,17-dinaphthalen-2-yl-N-phenyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-amine
CID 70892857
4-(13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-5-yl)-N,N-dinaphthalen-2-ylnaphthalen-1-amine
CID 70893032
N-phenyl-N-[4-(8,8,14,14-tetramethyl-17-phenyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)phenyl]naphthalen-1-amine
CID 70886178
N,N-diphenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)aniline
CID 70893138
N,N-diphenyl-4-(8,8,14,14-tetramethyl-17-phenyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)aniline
CID 70886158
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
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
4-[[4-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)naphthalen-1-yl]-naphthalen-2-ylamino]benzonitrile
CID 121419347
N-[4-(13,13-dimethyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-5-yl)phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
CID 70893086

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine?
The IUPAC name of N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine (CID 70885823) is N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine.
What is the SMILES notation for N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine?
The canonical SMILES for N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine is CC1(C)c2cccc3c2-n2c4c1cccc4c1cc(-c4ccc(N(c5ccccc5)c5ccc6ccccc6c5)c5ccccc45)cc(c12)C3(C)C.
What is the InChIKey of N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine?
The InChIKey is BSOHUSWJSUDMDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H38N2/c1-49(2)41-21-12-20-39-40-29-33(30-44-47(40)52(46(39)41)48-42(49)22-13-23-43(48)50(44,3)4)36-26-27-45(38-19-11-10-18-37(36)38)51(34-16-6-5-7-17-34)35-25-24-31-14-8-9-15-32(31)28-35/h5-30H,1-4H3.
What are the key properties of N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine?
N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine has a molecular weight of 666.87 g/mol, XLogP of 13.51, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-N-phenyl-4-(8,8,14,14-tetramethyl-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine is sourced from PubChem (CID 70885823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).