2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide

C13H23N3O3 — CID 175824302

IUPAC2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide
SMILESNC(=O)C(CCCN1CCCCC12COC2)NC=O
InChIInChI=1S/C13H23N3O3/c14-12(18)11(15-10-17)4-3-7-16-6-2-1-5-13(16)8-19-9-13/h10-11H,1-9H2,(H2,14,18)(H,15,17)
InChIKeyVTMSZWGFWRFMBH-UHFFFAOYSA-N
MW269.34 g/mol
LogP-0.38
Rot. Bonds7

About 2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide

2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide (PubChem CID 175824302) has the molecular formula C13H23N3O3 and a molecular weight of 269.34 g/mol. Its IUPAC name is 2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide.

Molecular Properties

Compound Name2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide
PubChem CID175824302
Molecular FormulaC13H23N3O3
Molecular Weight269.34 g/mol
Exact Mass269.17
IUPAC Name2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide
SMILESNC(=O)C(CCCN1CCCCC12COC2)NC=O
InChIInChI=1S/C13H23N3O3/c14-12(18)11(15-10-17)4-3-7-16-6-2-1-5-13(16)8-19-9-13/h10-11H,1-9H2,(H2,14,18)(H,15,17)
InChIKeyVTMSZWGFWRFMBH-UHFFFAOYSA-N
XLogP-0.38
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide?
The IUPAC name of 2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide (CID 175824302) is 2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide.
What is the SMILES notation for 2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide?
The canonical SMILES for 2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide is NC(=O)C(CCCN1CCCCC12COC2)NC=O.
What is the InChIKey of 2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide?
The InChIKey is VTMSZWGFWRFMBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O3/c14-12(18)11(15-10-17)4-3-7-16-6-2-1-5-13(16)8-19-9-13/h10-11H,1-9H2,(H2,14,18)(H,15,17).
What are the key properties of 2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide?
2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide has a molecular weight of 269.34 g/mol, XLogP of -0.38, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-formamido-5-(2-oxa-5-azaspiro[3.5]nonan-5-yl)pentanamide is sourced from PubChem (CID 175824302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).