N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide

C16H20N4O3 — CID 27533114

IUPACN-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide
SMILESO=C(CCc1cccnc1)NN1C(=O)NC2(CCCCC2)C1=O
InChIInChI=1S/C16H20N4O3/c21-13(7-6-12-5-4-10-17-11-12)19-20-14(22)16(18-15(20)23)8-2-1-3-9-16/h4-5,10-11H,1-3,6-9H2,(H,18,23)(H,19,21)
InChIKeyDUIKBXYWQBQDOD-UHFFFAOYSA-N
MW316.36 g/mol
LogP1.30
Rot. Bonds4

About N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide

N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide (PubChem CID 27533114) has the molecular formula C16H20N4O3 and a molecular weight of 316.36 g/mol. Its IUPAC name is N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide
PubChem CID27533114
Molecular FormulaC16H20N4O3
Molecular Weight316.36 g/mol
Exact Mass316.15
IUPAC NameN-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide
SMILESO=C(CCc1cccnc1)NN1C(=O)NC2(CCCCC2)C1=O
InChIInChI=1S/C16H20N4O3/c21-13(7-6-12-5-4-10-17-11-12)19-20-14(22)16(18-15(20)23)8-2-1-3-9-16/h4-5,10-11H,1-3,6-9H2,(H,18,23)(H,19,21)
InChIKeyDUIKBXYWQBQDOD-UHFFFAOYSA-N
XLogP1.30
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide?
The IUPAC name of N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide (CID 27533114) is N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide is O=C(CCc1cccnc1)NN1C(=O)NC2(CCCCC2)C1=O.
What is the InChIKey of N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide?
The InChIKey is DUIKBXYWQBQDOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O3/c21-13(7-6-12-5-4-10-17-11-12)19-20-14(22)16(18-15(20)23)8-2-1-3-9-16/h4-5,10-11H,1-3,6-9H2,(H,18,23)(H,19,21).
What are the key properties of N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide?
N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide has a molecular weight of 316.36 g/mol, XLogP of 1.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 27533114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).