[4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone

C15H21N3O2 — CID 75511380

IUPAC[4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone
SMILESCN(C)c1ccnc(C(=O)N2CCOCC23CCC3)c1
InChIInChI=1S/C15H21N3O2/c1-17(2)12-4-7-16-13(10-12)14(19)18-8-9-20-11-15(18)5-3-6-15/h4,7,10H,3,5-6,8-9,11H2,1-2H3
InChIKeySYBMVDKRSFUEFX-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.54
Rot. Bonds2

About [4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone

[4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone (PubChem CID 75511380) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is [4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone.

Molecular Properties

Compound Name[4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone
PubChem CID75511380
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name[4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone
SMILESCN(C)c1ccnc(C(=O)N2CCOCC23CCC3)c1
InChIInChI=1S/C15H21N3O2/c1-17(2)12-4-7-16-13(10-12)14(19)18-8-9-20-11-15(18)5-3-6-15/h4,7,10H,3,5-6,8-9,11H2,1-2H3
InChIKeySYBMVDKRSFUEFX-UHFFFAOYSA-N
XLogP1.54
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone?
The IUPAC name of [4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone (CID 75511380) is [4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone.
What is the SMILES notation for [4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone?
The canonical SMILES for [4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone is CN(C)c1ccnc(C(=O)N2CCOCC23CCC3)c1.
What is the InChIKey of [4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone?
The InChIKey is SYBMVDKRSFUEFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-17(2)12-4-7-16-13(10-12)14(19)18-8-9-20-11-15(18)5-3-6-15/h4,7,10H,3,5-6,8-9,11H2,1-2H3.
What are the key properties of [4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone?
[4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone has a molecular weight of 275.35 g/mol, XLogP of 1.54, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(dimethylamino)-2-pyridinyl]-(8-oxa-5-azaspiro[3.5]nonan-5-yl)methanone is sourced from PubChem (CID 75511380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).