2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine

C20H21N — CID 63416579

IUPAC2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine
SMILESCc1ccc(C)c(CC(N)c2ccc3ccccc3c2)c1
InChIInChI=1S/C20H21N/c1-14-7-8-15(2)19(11-14)13-20(21)18-10-9-16-5-3-4-6-17(16)12-18/h3-12,20H,13,21H2,1-2H3
InChIKeyDQBYCYBESSTCAP-UHFFFAOYSA-N
MW275.39 g/mol
LogP4.70
Rot. Bonds3

About 2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine

2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine (PubChem CID 63416579) has the molecular formula C20H21N and a molecular weight of 275.39 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine
PubChem CID63416579
Molecular FormulaC20H21N
Molecular Weight275.39 g/mol
Exact Mass275.17
IUPAC Name2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine
SMILESCc1ccc(C)c(CC(N)c2ccc3ccccc3c2)c1
InChIInChI=1S/C20H21N/c1-14-7-8-15(2)19(11-14)13-20(21)18-10-9-16-5-3-4-6-17(16)12-18/h3-12,20H,13,21H2,1-2H3
InChIKeyDQBYCYBESSTCAP-UHFFFAOYSA-N
XLogP4.70
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(5-fluoro-2-methylphenyl)-1-naphthalen-2-ylethanamine
CID 105373838
2-(2,5-dimethylphenyl)-1-quinolin-6-ylethanamine
CID 63097558
1-(1,3-benzodioxol-5-yl)-2-(2,5-dimethylphenyl)ethanamine
CID 62539511
2-(5-ethylthiophen-2-yl)-1-naphthalen-2-ylethanamine
CID 62716426
2-(2,5-dimethylphenyl)-1-(5-methoxy-3-pyridinyl)ethanamine
CID 105026220
2-[(2,5-dimethylphenyl)methyl]naphthalene
CID 101429734
1-(2,3-dimethylphenyl)-2-(2,5-dimethylphenyl)ethanamine
CID 62538026
3-(3-methylphenyl)-1-naphthalen-2-ylpropan-1-amine
CID 105141723
2-(3-methylphenoxy)-1-naphthalen-2-ylethanamine
CID 43093388
(1S)-1-naphthalen-2-ylbutan-1-amine
CID 55254735
2-(5-methyl-1,3-thiazol-2-yl)-1-naphthalen-2-ylethanamine
CID 82066770
(1R)-1-naphthalen-2-ylpentan-1-amine
CID 171201313

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine?
The IUPAC name of 2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine (CID 63416579) is 2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine?
The canonical SMILES for 2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine is Cc1ccc(C)c(CC(N)c2ccc3ccccc3c2)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine?
The InChIKey is DQBYCYBESSTCAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N/c1-14-7-8-15(2)19(11-14)13-20(21)18-10-9-16-5-3-4-6-17(16)12-18/h3-12,20H,13,21H2,1-2H3.
What are the key properties of 2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine?
2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine has a molecular weight of 275.39 g/mol, XLogP of 4.70, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-1-naphthalen-2-ylethanamine is sourced from PubChem (CID 63416579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).