(2S)-2-aminopropanoic acid;1,1'-biphenyl

C15H17NO2 — CID 66659859

IUPAC(2S)-2-aminopropanoic acid;1,1'-biphenyl
SMILESC[C@H](N)C(=O)O.c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H10.C3H7NO2/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2(4)3(5)6/h1-10H;2H,4H2,1H3,(H,5,6)/t;2-/m.0/s1
InChIKeySYVLFLAPCRVTTO-WNQIDUERSA-N
MW243.31 g/mol
LogP2.77
Rot. Bonds2

About (2S)-2-aminopropanoic acid;1,1'-biphenyl

(2S)-2-aminopropanoic acid;1,1'-biphenyl (PubChem CID 66659859) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is (2S)-2-aminopropanoic acid;1,1'-biphenyl.

Molecular Properties

Compound Name(2S)-2-aminopropanoic acid;1,1'-biphenyl
PubChem CID66659859
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name(2S)-2-aminopropanoic acid;1,1'-biphenyl
SMILESC[C@H](N)C(=O)O.c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H10.C3H7NO2/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2(4)3(5)6/h1-10H;2H,4H2,1H3,(H,5,6)/t;2-/m.0/s1
InChIKeySYVLFLAPCRVTTO-WNQIDUERSA-N
XLogP2.77
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-aminopropanoic acid;1,1'-biphenyl?
The IUPAC name of (2S)-2-aminopropanoic acid;1,1'-biphenyl (CID 66659859) is (2S)-2-aminopropanoic acid;1,1'-biphenyl.
What is the SMILES notation for (2S)-2-aminopropanoic acid;1,1'-biphenyl?
The canonical SMILES for (2S)-2-aminopropanoic acid;1,1'-biphenyl is C[C@H](N)C(=O)O.c1ccc(-c2ccccc2)cc1.
What is the InChIKey of (2S)-2-aminopropanoic acid;1,1'-biphenyl?
The InChIKey is SYVLFLAPCRVTTO-WNQIDUERSA-N. The full InChI is InChI=1S/C12H10.C3H7NO2/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2(4)3(5)6/h1-10H;2H,4H2,1H3,(H,5,6)/t;2-/m.0/s1.
What are the key properties of (2S)-2-aminopropanoic acid;1,1'-biphenyl?
(2S)-2-aminopropanoic acid;1,1'-biphenyl has a molecular weight of 243.31 g/mol, XLogP of 2.77, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-aminopropanoic acid;1,1'-biphenyl is sourced from PubChem (CID 66659859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).