N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide

C17H26N4O — CID 97396905

IUPACN-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide
SMILESCNC(=O)CN1CCCC12CCN(Cc1cccnc1)CC2
InChIInChI=1S/C17H26N4O/c1-18-16(22)14-21-9-3-5-17(21)6-10-20(11-7-17)13-15-4-2-8-19-12-15/h2,4,8,12H,3,5-7,9-11,13-14H2,1H3,(H,18,22)
InChIKeyVVLVHDPHLTVJOV-UHFFFAOYSA-N
MW302.42 g/mol
LogP1.26
Rot. Bonds4

About N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide

N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide (PubChem CID 97396905) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide
PubChem CID97396905
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC NameN-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide
SMILESCNC(=O)CN1CCCC12CCN(Cc1cccnc1)CC2
InChIInChI=1S/C17H26N4O/c1-18-16(22)14-21-9-3-5-17(21)6-10-20(11-7-17)13-15-4-2-8-19-12-15/h2,4,8,12H,3,5-7,9-11,13-14H2,1H3,(H,18,22)
InChIKeyVVLVHDPHLTVJOV-UHFFFAOYSA-N
XLogP1.26
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-[(4-methoxyphenyl)methyl]-1-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decane
CID 97372599
N,N-dimethyl-2-[2-(pyridin-3-ylmethyl)-2,6-diazaspiro[4.5]decan-6-yl]acetamide
CID 134070809
8-[(4-fluorophenyl)methyl]-1-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decane
CID 97372598
1-(pyridin-3-ylmethyl)-8-(thiophen-3-ylmethyl)-1,8-diazaspiro[4.5]decane;tris(2,2,2-trifluoroacetic acid)
CID 155824811
2-[8-[(2,5-dimethylpyrazol-3-yl)methyl]-1,8-diazaspiro[4.5]decan-1-yl]-N-methylacetamide
CID 97409287
N-methyl-2-[[(3S,5S)-9-(pyridin-3-ylmethyl)-1-oxa-9-azaspiro[4.5]decan-3-yl]oxy]acetamide
CID 97395316
3-[(4,4-difluoropiperidin-1-yl)methyl]pyridine
CID 117007748
(3-fluorophenyl)-[1-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-8-yl]methanone
CID 134078359
N-methyl-1-(pyridin-3-ylmethyl)-4-[(2-pyridin-3-ylphenyl)methyl]piperidine-4-carboxamide
CID 110083488
3-(pyrrolidin-1-ylmethyl)pyridine;dihydrochloride
CID 119103446
4-pyridin-3-yl-1-(pyridin-3-ylmethyl)piperidin-4-ol
CID 126470029
2-methyl-N-[8-(pyridin-3-ylmethyl)-1-oxa-8-azaspiro[4.5]decan-3-yl]propanamide
CID 118745549

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide?
The IUPAC name of N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide (CID 97396905) is N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide.
What is the SMILES notation for N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide?
The canonical SMILES for N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide is CNC(=O)CN1CCCC12CCN(Cc1cccnc1)CC2.
What is the InChIKey of N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide?
The InChIKey is VVLVHDPHLTVJOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c1-18-16(22)14-21-9-3-5-17(21)6-10-20(11-7-17)13-15-4-2-8-19-12-15/h2,4,8,12H,3,5-7,9-11,13-14H2,1H3,(H,18,22).
What are the key properties of N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide?
N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide has a molecular weight of 302.42 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[8-(pyridin-3-ylmethyl)-1,8-diazaspiro[4.5]decan-1-yl]acetamide is sourced from PubChem (CID 97396905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).