(2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine

C19H23N — CID 158552028

IUPAC(2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCc1cccc2c1CC[C@H](N[C@H](C)c1ccccc1)C2
InChIInChI=1S/C19H23N/c1-14-7-6-10-17-13-18(11-12-19(14)17)20-15(2)16-8-4-3-5-9-16/h3-10,15,18,20H,11-13H2,1-2H3/t15-,18+/m1/s1
InChIKeyIGSREDPCSAGZLB-QAPCUYQASA-N
MW265.40 g/mol
LogP4.20
Rot. Bonds3

About (2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine

(2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 158552028) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is (2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound Name(2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID158552028
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC Name(2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCc1cccc2c1CC[C@H](N[C@H](C)c1ccccc1)C2
InChIInChI=1S/C19H23N/c1-14-7-6-10-17-13-18(11-12-19(14)17)20-15(2)16-8-4-3-5-9-16/h3-10,15,18,20H,11-13H2,1-2H3/t15-,18+/m1/s1
InChIKeyIGSREDPCSAGZLB-QAPCUYQASA-N
XLogP4.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1S)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 81351587
5-methoxy-N-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 73455275
N-[1-(3-bromophenyl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 43426726
N-[(1S)-1-(4-chlorophenyl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 81353163
N-[(1S)-1-(4-methoxyphenyl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 81367851
N-[1-(4-methylphenyl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 54863084
4-(1-phenylethylamino)cyclohexan-1-one
CID 85299534
5-methyl-2-phenyl-1,2,3,4-tetrahydronaphthalene
CID 59215088
N-(1-phenylethyl)cyclododecanamine
CID 60662638
6-(1,1-diphenylpentan-3-ylamino)-5,6,7,8-tetrahydronaphthalen-1-ol
CID 19926577
(3R)-N-[(1S)-1-phenylethyl]-2,3,4,9-tetrahydro-1H-carbazol-3-amine;hydrochloride
CID 154734790
N-[(1S)-1-(4-fluorophenyl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 81348211

Frequently Asked Questions

What is the IUPAC name of (2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of (2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine (CID 158552028) is (2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for (2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for (2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine is Cc1cccc2c1CC[C@H](N[C@H](C)c1ccccc1)C2.
What is the InChIKey of (2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is IGSREDPCSAGZLB-QAPCUYQASA-N. The full InChI is InChI=1S/C19H23N/c1-14-7-6-10-17-13-18(11-12-19(14)17)20-15(2)16-8-4-3-5-9-16/h3-10,15,18,20H,11-13H2,1-2H3/t15-,18+/m1/s1.
What are the key properties of (2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine?
(2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 265.40 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-5-methyl-N-[(1R)-1-phenylethyl]-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 158552028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).