2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide

C15H20N4O3 — CID 95715417

IUPAC2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide
SMILESO=C(CN1CCC[C@]2(CNC(=O)O2)C1)NCc1ccccn1
InChIInChI=1S/C15H20N4O3/c20-13(17-8-12-4-1-2-6-16-12)9-19-7-3-5-15(11-19)10-18-14(21)22-15/h1-2,4,6H,3,5,7-11H2,(H,17,20)(H,18,21)/t15-/m0/s1
InChIKeyZUGAKOYDWHRGEE-HNNXBMFYSA-N
MW304.35 g/mol
LogP0.27
Rot. Bonds4

About 2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide

2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 95715417) has the molecular formula C15H20N4O3 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide
PubChem CID95715417
Molecular FormulaC15H20N4O3
Molecular Weight304.35 g/mol
Exact Mass304.15
IUPAC Name2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide
SMILESO=C(CN1CCC[C@]2(CNC(=O)O2)C1)NCc1ccccn1
InChIInChI=1S/C15H20N4O3/c20-13(17-8-12-4-1-2-6-16-12)9-19-7-3-5-15(11-19)10-18-14(21)22-15/h1-2,4,6H,3,5,7-11H2,(H,17,20)(H,18,21)/t15-/m0/s1
InChIKeyZUGAKOYDWHRGEE-HNNXBMFYSA-N
XLogP0.27
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(5R)-3-methyl-2-oxo-1-oxa-3,9-diazaspiro[4.6]undecan-9-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95726725
2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 108999232
2-[(2S)-5-oxospiro[3,4-dihydro-1,4-benzoxazepine-2,3'-piperidine]-1'-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 95796959
2-(4-benzylpiperazin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 46488455
2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 79333901
2-[(3R,4R)-3-hydroxy-3,4-dimethylpyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 72894294
2-(1-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 36714045
2-[4-[(2R)-2-hydroxy-3,3-dimethylbutyl]piperazin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95311404
2-[(2R)-2-phenylthiomorpholin-4-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 97214559
2-[(6S)-11-(pyridin-2-ylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]acetic acid
CID 97495025
2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 46056291
2-(6-hydroxy-4-propyl-1,4-diazepan-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 74242130

Frequently Asked Questions

What is the IUPAC name of 2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide (CID 95715417) is 2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide is O=C(CN1CCC[C@]2(CNC(=O)O2)C1)NCc1ccccn1.
What is the InChIKey of 2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is ZUGAKOYDWHRGEE-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H20N4O3/c20-13(17-8-12-4-1-2-6-16-12)9-19-7-3-5-15(11-19)10-18-14(21)22-15/h1-2,4,6H,3,5,7-11H2,(H,17,20)(H,18,21)/t15-/m0/s1.
What are the key properties of 2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide?
2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 304.35 g/mol, XLogP of 0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5S)-2-oxo-1-oxa-3,9-diazaspiro[4.5]decan-9-yl]-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 95715417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).