N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine

C21H23N — CID 163608925

IUPACN-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine
SMILESCc1cc(C)c(C)c(N(C)c2ccc3ccccc3c2)c1C
InChIInChI=1S/C21H23N/c1-14-12-15(2)17(4)21(16(14)3)22(5)20-11-10-18-8-6-7-9-19(18)13-20/h6-13H,1-5H3
InChIKeyBVSBMMRYKZJJTC-UHFFFAOYSA-N
MW289.42 g/mol
LogP5.84
Rot. Bonds2

About N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine

N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine (PubChem CID 163608925) has the molecular formula C21H23N and a molecular weight of 289.42 g/mol. Its IUPAC name is N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine.

Molecular Properties

Compound NameN-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine
PubChem CID163608925
Molecular FormulaC21H23N
Molecular Weight289.42 g/mol
Exact Mass289.18
IUPAC NameN-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine
SMILESCc1cc(C)c(C)c(N(C)c2ccc3ccccc3c2)c1C
InChIInChI=1S/C21H23N/c1-14-12-15(2)17(4)21(16(14)3)22(5)20-11-10-18-8-6-7-9-19(18)13-20/h6-13H,1-5H3
InChIKeyBVSBMMRYKZJJTC-UHFFFAOYSA-N
XLogP5.84
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500289.42
LogP ≤ 55.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3,4-dimethylphenyl)-N-methylnaphthalen-2-amine
CID 163968622
N-(3,5-dimethylphenyl)-N-methylnaphthalen-2-amine
CID 70891373
N,1-dimethyl-N-naphthalen-2-ylnaphthalen-2-amine
CID 143268733
1-N,4-N-dimethyl-4-N-(2,3,5,6-tetramethylphenyl)benzene-1,4-diamine
CID 117041371
N,2,3,5,6-pentamethyl-N-(2-methylphenyl)aniline
CID 163538008
ethane;N-methyl-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
CID 143983755
N-(3,5-dimethylphenyl)-N,2,3,5,6-pentamethylaniline
CID 163804278
N-methyl-N-oxidonaphthalen-2-amine
CID 163543073
N-methyl-N-(5-methylnaphthalen-2-yl)anthracen-9-amine
CID 144939685
5-bromo-N,3-dimethyl-N-naphthalen-2-ylpyridin-2-amine
CID 115148547
N-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)anthracen-2-amine
CID 89001926
N-methyl-N-naphthalen-2-ylquinolin-2-amine
CID 70891325

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine?
The IUPAC name of N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine (CID 163608925) is N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine.
What is the SMILES notation for N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine?
The canonical SMILES for N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine is Cc1cc(C)c(C)c(N(C)c2ccc3ccccc3c2)c1C.
What is the InChIKey of N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine?
The InChIKey is BVSBMMRYKZJJTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N/c1-14-12-15(2)17(4)21(16(14)3)22(5)20-11-10-18-8-6-7-9-19(18)13-20/h6-13H,1-5H3.
What are the key properties of N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine?
N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine has a molecular weight of 289.42 g/mol, XLogP of 5.84, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2,3,5,6-tetramethylphenyl)naphthalen-2-amine is sourced from PubChem (CID 163608925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).