[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine

C11H15N — CID 86313684

IUPAC[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine
SMILESNC[C@H]1CCc2ccccc2C1
InChIInChI=1S/C11H15N/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-4,9H,5-8,12H2/t9-/m0/s1
InChIKeyWKQAFPKAFXIRCK-VIFPVBQESA-N
MW161.25 g/mol
LogP1.75
Rot. Bonds1

About [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine

[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine (PubChem CID 86313684) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine.

Molecular Properties

Compound Name[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine
PubChem CID86313684
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine
SMILESNC[C@H]1CCc2ccccc2C1
InChIInChI=1S/C11H15N/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-4,9H,5-8,12H2/t9-/m0/s1
InChIKeyWKQAFPKAFXIRCK-VIFPVBQESA-N
XLogP1.75
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 ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,3,4-tetrahydronaphthalen-2-ylmethylhydrazine
CID 107126485
2-(2-bromoethyl)-1,2,3,4-tetrahydronaphthalene
CID 15752629
2-propyl-1,2,3,4-tetrahydronaphthalene
CID 13330225
(7S)-7-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-2-ol
CID 15718602
6-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-amine
CID 105436645
2-(methylsulfanylmethyl)-1,2,3,4-tetrahydronaphthalene
CID 130736237
(2S)-2-prop-2-enyl-1,2,3,4-tetrahydronaphthalene
CID 129383765
benzene;1,2,3,4-tetrahydronaphthalen-2-amine
CID 66647094
1,2,3,4-tetrahydronaphthalen-2-amine;trihydrochloride
CID 67686398
4,5,6,7-tetrahydro-2H-isoindol-5-ylmethanamine
CID 12973048
3-(1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-ol
CID 67879898
(6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 15718592

Frequently Asked Questions

What is the IUPAC name of [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine?
The IUPAC name of [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine (CID 86313684) is [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine.
What is the SMILES notation for [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine?
The canonical SMILES for [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine is NC[C@H]1CCc2ccccc2C1.
What is the InChIKey of [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine?
The InChIKey is WKQAFPKAFXIRCK-VIFPVBQESA-N. The full InChI is InChI=1S/C11H15N/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-4,9H,5-8,12H2/t9-/m0/s1.
What are the key properties of [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine?
[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine has a molecular weight of 161.25 g/mol, XLogP of 1.75, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine is sourced from PubChem (CID 86313684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).