1,2,3,4-tetrahydronaphthalen-1-ylmethanamine

C11H15N — CID 11298132

IUPAC1,2,3,4-tetrahydronaphthalen-1-ylmethanamine
SMILESNCC1CCCc2ccccc21
InChIInChI=1S/C11H15N/c12-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-2,4,7,10H,3,5-6,8,12H2
InChIKeyFSEUPTSLGGJFNX-UHFFFAOYSA-N
MW161.25 g/mol
LogP2.07
Rot. Bonds1

About 1,2,3,4-tetrahydronaphthalen-1-ylmethanamine

1,2,3,4-tetrahydronaphthalen-1-ylmethanamine (PubChem CID 11298132) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is 1,2,3,4-tetrahydronaphthalen-1-ylmethanamine.

Molecular Properties

Compound Name1,2,3,4-tetrahydronaphthalen-1-ylmethanamine
PubChem CID11298132
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name1,2,3,4-tetrahydronaphthalen-1-ylmethanamine
SMILESNCC1CCCc2ccccc21
InChIInChI=1S/C11H15N/c12-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-2,4,7,10H,3,5-6,8,12H2
InChIKeyFSEUPTSLGGJFNX-UHFFFAOYSA-N
XLogP2.07
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4-tetrahydronaphthalen-1-ylmethanamine?
The IUPAC name of 1,2,3,4-tetrahydronaphthalen-1-ylmethanamine (CID 11298132) is 1,2,3,4-tetrahydronaphthalen-1-ylmethanamine.
What is the SMILES notation for 1,2,3,4-tetrahydronaphthalen-1-ylmethanamine?
The canonical SMILES for 1,2,3,4-tetrahydronaphthalen-1-ylmethanamine is NCC1CCCc2ccccc21.
What is the InChIKey of 1,2,3,4-tetrahydronaphthalen-1-ylmethanamine?
The InChIKey is FSEUPTSLGGJFNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N/c12-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-2,4,7,10H,3,5-6,8,12H2.
What are the key properties of 1,2,3,4-tetrahydronaphthalen-1-ylmethanamine?
1,2,3,4-tetrahydronaphthalen-1-ylmethanamine has a molecular weight of 161.25 g/mol, XLogP of 2.07, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4-tetrahydronaphthalen-1-ylmethanamine is sourced from PubChem (CID 11298132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).