(2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine

C20H26N2 — CID 69172231

IUPAC(2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCc1cccc2c1CC[C@@H](N)C2CN(C)Cc1ccccc1
InChIInChI=1S/C20H26N2/c1-15-7-6-10-18-17(15)11-12-20(21)19(18)14-22(2)13-16-8-4-3-5-9-16/h3-10,19-20H,11-14,21H2,1-2H3/t19?,20-/m1/s1
InChIKeySXYHZGNNWYSFEL-GFOWMXPYSA-N
MW294.44 g/mol
LogP3.48
Rot. Bonds4

About (2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine

(2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 69172231) has the molecular formula C20H26N2 and a molecular weight of 294.44 g/mol. Its IUPAC name is (2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound Name(2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID69172231
Molecular FormulaC20H26N2
Molecular Weight294.44 g/mol
Exact Mass294.21
IUPAC Name(2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCc1cccc2c1CC[C@@H](N)C2CN(C)Cc1ccccc1
InChIInChI=1S/C20H26N2/c1-15-7-6-10-18-17(15)11-12-20(21)19(18)14-22(2)13-16-8-4-3-5-9-16/h3-10,19-20H,11-14,21H2,1-2H3/t19?,20-/m1/s1
InChIKeySXYHZGNNWYSFEL-GFOWMXPYSA-N
XLogP3.48
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of (2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine (CID 69172231) is (2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for (2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for (2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine is Cc1cccc2c1CC[C@@H](N)C2CN(C)Cc1ccccc1.
What is the InChIKey of (2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is SXYHZGNNWYSFEL-GFOWMXPYSA-N. The full InChI is InChI=1S/C20H26N2/c1-15-7-6-10-18-17(15)11-12-20(21)19(18)14-22(2)13-16-8-4-3-5-9-16/h3-10,19-20H,11-14,21H2,1-2H3/t19?,20-/m1/s1.
What are the key properties of (2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine?
(2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 294.44 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[[benzyl(methyl)amino]methyl]-5-methyl-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 69172231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).