(1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine

C19H21N — CID 7202032

IUPAC(1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESC(=C/c1ccccc1)\CN[C@H]1CCCc2ccccc21
InChIInChI=1S/C19H21N/c1-2-8-16(9-3-1)10-7-15-20-19-14-6-12-17-11-4-5-13-18(17)19/h1-5,7-11,13,19-20H,6,12,14-15H2/b10-7+/t19-/m0/s1
InChIKeyFSJJBKZFODAUPN-VQFGERMISA-N
MW263.38 g/mol
LogP4.37
Rot. Bonds4

About (1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine

(1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 7202032) has the molecular formula C19H21N and a molecular weight of 263.38 g/mol. Its IUPAC name is (1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name(1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID7202032
Molecular FormulaC19H21N
Molecular Weight263.38 g/mol
Exact Mass263.17
IUPAC Name(1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESC(=C/c1ccccc1)\CN[C@H]1CCCc2ccccc21
InChIInChI=1S/C19H21N/c1-2-8-16(9-3-1)10-7-15-20-19-14-6-12-17-11-4-5-13-18(17)19/h1-5,7-11,13,19-20H,6,12,14-15H2/b10-7+/t19-/m0/s1
InChIKeyFSJJBKZFODAUPN-VQFGERMISA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[(E)-3-phenylprop-2-enyl]-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium
CID 7202031
(E)-2-phenyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethenesulfonamide
CID 2375188
N'-(1,2,3,4-tetrahydronaphthalen-1-yl)ethane-1,2-diamine
CID 60888348
3-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propanoic acid
CID 43087276
methyl 2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)acetate
CID 19794096
N-(cyclopentylmethyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 43370921
N-(3-methyl-2-propan-2-ylbutyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 102904359
N-[[(2S)-pyrrolidin-2-yl]methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 143330144
N-(4-phenylbutyl)-1,2,3,4-tetrahydronaphthalen-1-amine;dihydrochloride
CID 19773300
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]formamide
CID 45098245
N-(pyridin-4-ylmethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 3755839
N-[(2-ethylphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 62391908

Frequently Asked Questions

What is the IUPAC name of (1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of (1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine (CID 7202032) is (1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for (1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for (1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine is C(=C/c1ccccc1)\CN[C@H]1CCCc2ccccc21.
What is the InChIKey of (1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is FSJJBKZFODAUPN-VQFGERMISA-N. The full InChI is InChI=1S/C19H21N/c1-2-8-16(9-3-1)10-7-15-20-19-14-6-12-17-11-4-5-13-18(17)19/h1-5,7-11,13,19-20H,6,12,14-15H2/b10-7+/t19-/m0/s1.
What are the key properties of (1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine?
(1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 263.38 g/mol, XLogP of 4.37, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-N-[(E)-3-phenylprop-2-enyl]-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 7202032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).