N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide

C18H28N4O — CID 134070809

IUPACN,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide
SMILESCN(C)C(=O)CN1CCCCC12CCN(Cc1cccnc1)C2
InChIInChI=1S/C18H28N4O/c1-20(2)17(23)14-22-10-4-3-7-18(22)8-11-21(15-18)13-16-6-5-9-19-12-16/h5-6,9,12H,3-4,7-8,10-11,13-15H2,1-2H3
InChIKeyDYWANFJLZBBEQA-UHFFFAOYSA-N
MW316.45 g/mol
LogP1.60
Rot. Bonds4

About N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide

N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide (PubChem CID 134070809) has the molecular formula C18H28N4O and a molecular weight of 316.45 g/mol. Its IUPAC name is N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide
PubChem CID134070809
Molecular FormulaC18H28N4O
Molecular Weight316.45 g/mol
Exact Mass316.23
IUPAC NameN,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide
SMILESCN(C)C(=O)CN1CCCCC12CCN(Cc1cccnc1)C2
InChIInChI=1S/C18H28N4O/c1-20(2)17(23)14-22-10-4-3-7-18(22)8-11-21(15-18)13-16-6-5-9-19-12-16/h5-6,9,12H,3-4,7-8,10-11,13-15H2,1-2H3
InChIKeyDYWANFJLZBBEQA-UHFFFAOYSA-N
XLogP1.60
TPSA39.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.45
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide
CID 97396905
N,N-dimethyl-3-pyrazol-1-yl-1-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 155878997
N,N-dimethyl-2-[10-oxo-3-(pyridin-3-ylmethyl)-7-oxa-3,11-diazaspiro[5.6]dodecan-11-yl]acetamide
CID 155503725
1-[(4-fluorophenyl)methyl]-7-(pyridin-3-ylmethyl)-1,7-diazaspiro[3.4]octane
CID 134079041
[7-(pyridin-3-ylmethyl)-2,7-diazaspiro[3.4]octan-2-yl]-pyrrolidin-1-ylmethanone
CID 97392828
cyclopentyl-[1'-(pyridin-3-ylmethyl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone
CID 134789983
phenyl-[1'-(pyridin-3-ylmethyl)spiro[2,4-dihydroquinoline-3,2'-piperidine]-1-yl]methanone
CID 134791465
3-anilino-N,N-dimethyl-1-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 155879167
8-[(4-fluorophenyl)methyl]-1-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decane
CID 97372598
8-[(4-methoxyphenyl)methyl]-1-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decane
CID 97372599
2-[[(4aR,8aS)-6-(pyridin-3-ylmethyl)-3,4,5,7,8,8a-hexahydro-2H-pyrano[3,2-c]pyridin-4a-yl]methoxy]-N,N-dimethylacetamide
CID 97363759
(2S)-N,N-dimethyl-2-pyrazin-2-yl-1-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide
CID 124986361

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide?
The IUPAC name of N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide (CID 134070809) is N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide is CN(C)C(=O)CN1CCCCC12CCN(Cc1cccnc1)C2.
What is the InChIKey of N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide?
The InChIKey is DYWANFJLZBBEQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4O/c1-20(2)17(23)14-22-10-4-3-7-18(22)8-11-21(15-18)13-16-6-5-9-19-12-16/h5-6,9,12H,3-4,7-8,10-11,13-15H2,1-2H3.
What are the key properties of N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide?
N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide has a molecular weight of 316.45 g/mol, XLogP of 1.60, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide is sourced from PubChem (CID 134070809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).