N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine

C13H19N — CID 169040576

IUPACN-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCCNC1CCc2cc(C)ccc2C1
InChIInChI=1S/C13H19N/c1-3-14-13-7-6-11-8-10(2)4-5-12(11)9-13/h4-5,8,13-14H,3,6-7,9H2,1-2H3
InChIKeyIJMJKOZTJYBOIB-UHFFFAOYSA-N
MW189.30 g/mol
LogP2.46
Rot. Bonds2

About N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine

N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 169040576) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound NameN-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID169040576
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC NameN-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCCNC1CCc2cc(C)ccc2C1
InChIInChI=1S/C13H19N/c1-3-14-13-7-6-11-8-10(2)4-5-12(11)9-13/h4-5,8,13-14H,3,6-7,9H2,1-2H3
InChIKeyIJMJKOZTJYBOIB-UHFFFAOYSA-N
XLogP2.46
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine (CID 169040576) is N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine is CCNC1CCc2cc(C)ccc2C1.
What is the InChIKey of N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is IJMJKOZTJYBOIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-3-14-13-7-6-11-8-10(2)4-5-12(11)9-13/h4-5,8,13-14H,3,6-7,9H2,1-2H3.
What are the key properties of N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine?
N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 189.30 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 169040576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).