[(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium

C15H23N2O+ — CID 8859258

IUPAC[(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium
SMILESC[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CCCC2)C(N)=O
InChIInChI=1S/C15H22N2O/c1-10(17-11(2)15(16)18)13-8-7-12-5-3-4-6-14(12)9-13/h7-11,17H,3-6H2,1-2H3,(H2,16,18)/p+1/t10-,11-/m1/s1
InChIKeyBKVAIRJAONNEAG-GHMZBOCLSA-O
MW247.36 g/mol
LogP1.06
Rot. Bonds4

About [(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium

[(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium (PubChem CID 8859258) has the molecular formula C15H23N2O+ and a molecular weight of 247.36 g/mol. Its IUPAC name is [(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium.

Molecular Properties

Compound Name[(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium
PubChem CID8859258
Molecular FormulaC15H23N2O+
Molecular Weight247.36 g/mol
Exact Mass247.18
IUPAC Name[(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium
SMILESC[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CCCC2)C(N)=O
InChIInChI=1S/C15H22N2O/c1-10(17-11(2)15(16)18)13-8-7-12-5-3-4-6-14(12)9-13/h7-11,17H,3-6H2,1-2H3,(H2,16,18)/p+1/t10-,11-/m1/s1
InChIKeyBKVAIRJAONNEAG-GHMZBOCLSA-O
XLogP1.06
TPSA59.70 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze [(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium with MolForge

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Related Compounds

[(2S)-1-(carbamoylamino)-1-oxopropan-2-yl]-[(1S)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium
CID 8859206
2-(methylamino)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 116961596
3-(2,3-dihydro-1H-inden-5-yl)butanamide
CID 82076746
3-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid
CID 20556031
2-(5,6,7,8-tetrahydronaphthalen-2-yl)propanoyl chloride
CID 117047620
3-[1-(2,3-dihydro-1H-inden-5-yl)ethylamino]-2-hydroxypropanamide
CID 114153528
[(2S)-1-(4-fluoro-3-nitroanilino)-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium
CID 8859131
1-(2,3-dihydro-1H-inden-5-yl)-1-hydroxy-3-methylbutan-2-one
CID 116835964
ethyl 2-(2,3-dihydro-1H-inden-5-yl)propanoate
CID 164900857
1-(2,3-dihydro-1H-inden-5-yl)-2-methylpropan-1-ol
CID 61087028
2-methyl-2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanamide
CID 61220351
3-amino-3-(5,6,7,8-tetrahydronaphthalen-2-yl)propanamide
CID 116850923

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium?
The IUPAC name of [(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium (CID 8859258) is [(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium.
What is the SMILES notation for [(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium?
The canonical SMILES for [(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium is C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CCCC2)C(N)=O.
What is the InChIKey of [(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium?
The InChIKey is BKVAIRJAONNEAG-GHMZBOCLSA-O. The full InChI is InChI=1S/C15H22N2O/c1-10(17-11(2)15(16)18)13-8-7-12-5-3-4-6-14(12)9-13/h7-11,17H,3-6H2,1-2H3,(H2,16,18)/p+1/t10-,11-/m1/s1.
What are the key properties of [(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium?
[(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium has a molecular weight of 247.36 g/mol, XLogP of 1.06, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-amino-1-oxopropan-2-yl]-[(1R)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]azanium is sourced from PubChem (CID 8859258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).