(2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide

C11H19N3O3 — CID 134244177

IUPAC(2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide
SMILESN[C@@H](CO)C(=O)NC1CCC2(CC1)CNC2=O
InChIInChI=1S/C11H19N3O3/c12-8(5-15)9(16)14-7-1-3-11(4-2-7)6-13-10(11)17/h7-8,15H,1-6,12H2,(H,13,17)(H,14,16)/t7?,8-,11?/m0/s1
InChIKeyANYCLFCDSXWEBH-KAIZJQOQSA-N
MW241.29 g/mol
LogP-1.52
Rot. Bonds3

About (2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide

(2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide (PubChem CID 134244177) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is (2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide
PubChem CID134244177
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name(2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide
SMILESN[C@@H](CO)C(=O)NC1CCC2(CC1)CNC2=O
InChIInChI=1S/C11H19N3O3/c12-8(5-15)9(16)14-7-1-3-11(4-2-7)6-13-10(11)17/h7-8,15H,1-6,12H2,(H,13,17)(H,14,16)/t7?,8-,11?/m0/s1
InChIKeyANYCLFCDSXWEBH-KAIZJQOQSA-N
XLogP-1.52
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-1.52
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)-3-sulfanylpropanamide
CID 138664759
(2R)-2-amino-3-hydroxy-N-(4-hydroxycyclohexyl)propanamide
CID 70908971
(2R)-2-amino-3-hydroxy-N-[(1S,3R)-4-hydroxy-3-methylcyclohexyl]propanamide
CID 163739799
2-methyl-N-(3-oxospiro[3.5]nonan-7-yl)propanamide
CID 159536541
(2S)-2-amino-N-(cyclopropylmethyl)-3-hydroxypropanamide
CID 70262272
2-amino-N-(6-oxopiperidin-3-yl)pentanamide
CID 63661228
(2R)-2-amino-N-[(3S)-2-oxopyrrolidin-3-yl]butanamide
CID 164662315
(2S)-2-amino-3-cyclopentyl-N-cyclopropylpropanamide;hydrochloride
CID 118704811
(2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide
CID 106187633
(2R)-2-amino-4-methyl-N-(5-oxopyrrolidin-3-yl)pentanamide
CID 106187627
2-amino-N-(1-pyrimidin-2-ylpiperidin-4-yl)butanediamide
CID 60846790
2-amino-N-(5-oxopyrrolidin-3-yl)-3-phenylpropanamide
CID 106187812

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide?
The IUPAC name of (2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide (CID 134244177) is (2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide.
What is the SMILES notation for (2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide?
The canonical SMILES for (2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide is N[C@@H](CO)C(=O)NC1CCC2(CC1)CNC2=O.
What is the InChIKey of (2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide?
The InChIKey is ANYCLFCDSXWEBH-KAIZJQOQSA-N. The full InChI is InChI=1S/C11H19N3O3/c12-8(5-15)9(16)14-7-1-3-11(4-2-7)6-13-10(11)17/h7-8,15H,1-6,12H2,(H,13,17)(H,14,16)/t7?,8-,11?/m0/s1.
What are the key properties of (2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide?
(2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide has a molecular weight of 241.29 g/mol, XLogP of -1.52, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-3-hydroxy-N-(3-oxo-2-azaspiro[3.5]nonan-7-yl)propanamide is sourced from PubChem (CID 134244177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).