N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine

C22H29N — CID 163726619

IUPACN,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine
SMILESCc1ccccc1N(C)c1cccc2c1C(C)(C)CCC2(C)C
InChIInChI=1S/C22H29N/c1-16-10-7-8-12-18(16)23(6)19-13-9-11-17-20(19)22(4,5)15-14-21(17,2)3/h7-13H,14-15H2,1-6H3
InChIKeyWPKMCXVSCUPXOH-UHFFFAOYSA-N
MW307.48 g/mol
LogP6.11
Rot. Bonds2

About N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine

N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine (PubChem CID 163726619) has the molecular formula C22H29N and a molecular weight of 307.48 g/mol. Its IUPAC name is N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine.

Molecular Properties

Compound NameN,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine
PubChem CID163726619
Molecular FormulaC22H29N
Molecular Weight307.48 g/mol
Exact Mass307.23
IUPAC NameN,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine
SMILESCc1ccccc1N(C)c1cccc2c1C(C)(C)CCC2(C)C
InChIInChI=1S/C22H29N/c1-16-10-7-8-12-18(16)23(6)19-13-9-11-17-20(19)22(4,5)15-14-21(17,2)3/h7-13H,14-15H2,1-6H3
InChIKeyWPKMCXVSCUPXOH-UHFFFAOYSA-N
XLogP6.11
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.48
LogP ≤ 56.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-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-(2,4-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-4-amine
CID 163846157
N,1,1,3,3-pentamethyl-N-phenyl-2H-inden-4-amine
CID 163846154
benzene;1,1,4,4-tetramethyl-2,3-dihydronaphthalene
CID 173031980
5,5,8,8-tetramethyl-N-phenyl-N-[4-[3-(N-phenylanilino)phenyl]phenyl]-6,7-dihydronaphthalen-1-amine
CID 170222900
N,10-dimethyl-N-phenylcyclodeca-1,3,5,7,9-pentaen-1-amine
CID 135227535
N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine
CID 70891282
N,2-dimethyl-N-(1,2,2-trimethylcyclopropyl)aniline
CID 166727100
5,5,8,8-tetramethyl-N-naphthalen-1-yl-N-[3-[3-(N-naphthalen-1-ylanilino)phenyl]phenyl]-6,7-dihydronaphthalen-1-amine
CID 170222950
1,1,1',1',4,4'-hexamethyl-3,3'-spirobi[2H-indene]
CID 157166013
2-N,4,5-trimethyl-2-N-(2-methylphenyl)benzene-1,2-diamine
CID 114281251
2-(N,2-dimethylanilino)-N,N-diethyl-6-methylbenzamide
CID 25179562
2-methyl-N-(2-methylphenyl)-N-phosphanylaniline
CID 158300974

Frequently Asked Questions

What is the IUPAC name of N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine?
The IUPAC name of N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine (CID 163726619) is N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine.
What is the SMILES notation for N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine?
The canonical SMILES for N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine is Cc1ccccc1N(C)c1cccc2c1C(C)(C)CCC2(C)C.
What is the InChIKey of N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine?
The InChIKey is WPKMCXVSCUPXOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N/c1-16-10-7-8-12-18(16)23(6)19-13-9-11-17-20(19)22(4,5)15-14-21(17,2)3/h7-13H,14-15H2,1-6H3.
What are the key properties of N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine?
N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine has a molecular weight of 307.48 g/mol, XLogP of 6.11, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine is sourced from PubChem (CID 163726619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).