1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone

C19H29N3O — CID 124967719

IUPAC1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone
SMILESCCN(C)[C@H]1CN(C(=O)Cc2ccccn2)C2(CCCCC2)C1
InChIInChI=1S/C19H29N3O/c1-3-21(2)17-14-19(10-6-4-7-11-19)22(15-17)18(23)13-16-9-5-8-12-20-16/h5,8-9,12,17H,3-4,6-7,10-11,13-15H2,1-2H3/t17-/m1/s1
InChIKeyIVEFYXWNCWFJFB-QGZVFWFLSA-N
MW315.46 g/mol
LogP2.88
Rot. Bonds4

About 1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone

1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone (PubChem CID 124967719) has the molecular formula C19H29N3O and a molecular weight of 315.46 g/mol. Its IUPAC name is 1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone.

Molecular Properties

Compound Name1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone
PubChem CID124967719
Molecular FormulaC19H29N3O
Molecular Weight315.46 g/mol
Exact Mass315.23
IUPAC Name1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone
SMILESCCN(C)[C@H]1CN(C(=O)Cc2ccccn2)C2(CCCCC2)C1
InChIInChI=1S/C19H29N3O/c1-3-21(2)17-14-19(10-6-4-7-11-19)22(15-17)18(23)13-16-9-5-8-12-20-16/h5,8-9,12,17H,3-4,6-7,10-11,13-15H2,1-2H3/t17-/m1/s1
InChIKeyIVEFYXWNCWFJFB-QGZVFWFLSA-N
XLogP2.88
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.46
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone with MolForge

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Related Compounds

1-(3,4-dihydroxypyrrolidin-1-yl)-2-pyridin-2-ylethanone
CID 106671158
1-(3-methylpiperidin-1-yl)-2-pyridin-2-ylethanone
CID 110696959
1-(3-hydroxy-4,4-dimethylpiperidin-1-yl)-2-pyridin-2-ylethanone
CID 115276738
1-(3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridin-2-ylethanone
CID 112534802
1-(1,4-diazaspiro[5.5]undecan-1-yl)-3-pyridin-2-ylpropan-1-one
CID 114289996
1-(2,2-dimethylcyclohexyl)-2-pyridin-2-ylethanone
CID 107179819
1-(8,8-difluoro-3-azabicyclo[3.2.1]octan-3-yl)-2-pyridin-2-ylethanone
CID 131687605
N-methyl-N-(1-methylpiperidin-4-yl)-2-pyridin-2-ylacetamide
CID 110468198
1-[(2R,3aS,9aS)-2-benzyl-3a-methyl-2,3,5,6,7,8,9,9a-octahydro-1H-pyrrolo[3,2-b]azocin-4-yl]-2-pyridin-2-ylethanone
CID 110137503
1-[4-[methyl(pyridin-2-ylmethyl)amino]piperidin-1-yl]ethanone
CID 83290596
N-[1-[2-(3,5-dimethyl-1,2,4-triazol-1-yl)acetyl]-1-azaspiro[4.5]decan-3-yl]-N-ethylacetamide
CID 110130401
(4S)-4-phenyl-8-(2-pyridin-2-ylacetyl)-2,8-diazaspiro[4.5]decan-1-one
CID 97452786

Frequently Asked Questions

What is the IUPAC name of 1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone?
The IUPAC name of 1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone (CID 124967719) is 1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone.
What is the SMILES notation for 1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone?
The canonical SMILES for 1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone is CCN(C)[C@H]1CN(C(=O)Cc2ccccn2)C2(CCCCC2)C1.
What is the InChIKey of 1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone?
The InChIKey is IVEFYXWNCWFJFB-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H29N3O/c1-3-21(2)17-14-19(10-6-4-7-11-19)22(15-17)18(23)13-16-9-5-8-12-20-16/h5,8-9,12,17H,3-4,6-7,10-11,13-15H2,1-2H3/t17-/m1/s1.
What are the key properties of 1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone?
1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone has a molecular weight of 315.46 g/mol, XLogP of 2.88, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-3-[ethyl(methyl)amino]-1-azaspiro[4.5]decan-1-yl]-2-pyridin-2-ylethanone is sourced from PubChem (CID 124967719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).