(1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine

C12H15N — CID 130914652

IUPAC(1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESC=Cc1ccc2c(c1)CCC[C@@H]2N
InChIInChI=1S/C12H15N/c1-2-9-6-7-11-10(8-9)4-3-5-12(11)13/h2,6-8,12H,1,3-5,13H2/t12-/m0/s1
InChIKeyNTKBYZLHIXXENM-LBPRGKRZSA-N
MW173.26 g/mol
LogP2.67
Rot. Bonds1

About (1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine

(1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 130914652) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is (1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name(1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID130914652
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name(1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESC=Cc1ccc2c(c1)CCC[C@@H]2N
InChIInChI=1S/C12H15N/c1-2-9-6-7-11-10(8-9)4-3-5-12(11)13/h2,6-8,12H,1,3-5,13H2/t12-/m0/s1
InChIKeyNTKBYZLHIXXENM-LBPRGKRZSA-N
XLogP2.67
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(E)-3-[(5S)-5-amino-5,6,7,8-tetrahydronaphthalen-2-yl]prop-2-enenitrile
CID 59747934
N-[(6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-yl)methylidene]hydroxylamine
CID 174657798
(1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine
CID 71416765
1-amino-2,3-dihydro-1H-indene-5-carbaldehyde
CID 56947686
6-fluoro-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride
CID 71757709
6-N-methyl-1,2,3,4-tetrahydronaphthalene-1,6-diamine
CID 83816639
4-amino-7-ethenyl-3,4-dihydro-2H-naphthalen-1-one
CID 130040392
5-ethenyl-2,3-dihydro-1H-indene
CID 59801498
1-[(5S)-5-amino-5,6,7,8-tetrahydronaphthalen-2-yl]ethanone
CID 130615296
5-amino-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid;chloromethane
CID 159655491
7-ethenyl-4-methyl-3-methylidene-2,4-dihydro-1H-naphthalene
CID 145472095
(5-amino-5,6,7,8-tetrahydronaphthalen-2-yl)carbamic acid
CID 135386697

Frequently Asked Questions

What is the IUPAC name of (1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of (1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine (CID 130914652) is (1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for (1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for (1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine is C=Cc1ccc2c(c1)CCC[C@@H]2N.
What is the InChIKey of (1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is NTKBYZLHIXXENM-LBPRGKRZSA-N. The full InChI is InChI=1S/C12H15N/c1-2-9-6-7-11-10(8-9)4-3-5-12(11)13/h2,6-8,12H,1,3-5,13H2/t12-/m0/s1.
What are the key properties of (1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine?
(1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 173.26 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 130914652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).