[(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium

C15H26N3O4Y- — CID 59601400

IUPAC[(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium
SMILESCC(C)[C@H]([NH-])C(=O)N1CCCCC1C(=O)N[C@H](C)CC(=O)O.[Y]
InChIInChI=1S/C15H26N3O4.Y/c1-9(2)13(16)15(22)18-7-5-4-6-11(18)14(21)17-10(3)8-12(19)20;/h9-11,13,16H,4-8H2,1-3H3,(H,17,21)(H,19,20);/q-1;/t10-,11?,13+;/m1./s1
InChIKeyZFMWURKQHGMXIW-OODHIBIBSA-N
MW401.30 g/mol
LogP1.42
Rot. Bonds6

About [(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium

[(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium (PubChem CID 59601400) has the molecular formula C15H26N3O4Y- and a molecular weight of 401.30 g/mol. Its IUPAC name is [(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium.

Molecular Properties

Compound Name[(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium
PubChem CID59601400
Molecular FormulaC15H26N3O4Y-
Molecular Weight401.30 g/mol
Exact Mass401.10
IUPAC Name[(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium
SMILESCC(C)[C@H]([NH-])C(=O)N1CCCCC1C(=O)N[C@H](C)CC(=O)O.[Y]
InChIInChI=1S/C15H26N3O4.Y/c1-9(2)13(16)15(22)18-7-5-4-6-11(18)14(21)17-10(3)8-12(19)20;/h9-11,13,16H,4-8H2,1-3H3,(H,17,21)(H,19,20);/q-1;/t10-,11?,13+;/m1./s1
InChIKeyZFMWURKQHGMXIW-OODHIBIBSA-N
XLogP1.42
TPSA110.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.30
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium?
The IUPAC name of [(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium (CID 59601400) is [(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium.
What is the SMILES notation for [(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium?
The canonical SMILES for [(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium is CC(C)[C@H]([NH-])C(=O)N1CCCCC1C(=O)N[C@H](C)CC(=O)O.[Y].
What is the InChIKey of [(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium?
The InChIKey is ZFMWURKQHGMXIW-OODHIBIBSA-N. The full InChI is InChI=1S/C15H26N3O4.Y/c1-9(2)13(16)15(22)18-7-5-4-6-11(18)14(21)17-10(3)8-12(19)20;/h9-11,13,16H,4-8H2,1-3H3,(H,17,21)(H,19,20);/q-1;/t10-,11?,13+;/m1./s1.
What are the key properties of [(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium?
[(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium has a molecular weight of 401.30 g/mol, XLogP of 1.42, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-1-[2-[[(2R)-1-carboxypropan-2-yl]carbamoyl]piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]azanide;yttrium is sourced from PubChem (CID 59601400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).