3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione

C15H20N4O2 — CID 62207122

IUPAC3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESCNc1ccc(CN2C(=O)NC3(CCCCC3)C2=O)cn1
InChIInChI=1S/C15H20N4O2/c1-16-12-6-5-11(9-17-12)10-19-13(20)15(18-14(19)21)7-3-2-4-8-15/h5-6,9H,2-4,7-8,10H2,1H3,(H,16,17)(H,18,21)
InChIKeyUPRXCIAHEANXHQ-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.88
Rot. Bonds3

About 3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione

3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione (PubChem CID 62207122) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione
PubChem CID62207122
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESCNc1ccc(CN2C(=O)NC3(CCCCC3)C2=O)cn1
InChIInChI=1S/C15H20N4O2/c1-16-12-6-5-11(9-17-12)10-19-13(20)15(18-14(19)21)7-3-2-4-8-15/h5-6,9H,2-4,7-8,10H2,1H3,(H,16,17)(H,18,21)
InChIKeyUPRXCIAHEANXHQ-UHFFFAOYSA-N
XLogP1.88
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[(4-methylphenyl)methyl]-1,3-diazaspiro[4.7]dodecane-2,4-dione
CID 112774081
3-[(4-methylphenyl)methyl]-1,3-diazaspiro[4.5]decane-2,4-dione
CID 4810094
3,3-dimethyl-1-[[6-(methylamino)-3-pyridinyl]methyl]pyrrolidine-2,5-dione
CID 65301250
3-[(4-methoxyphenyl)methyl]-1,3-diazaspiro[4.5]decane-2,4-dione
CID 130201562
3-[[4-(hydroxymethyl)phenyl]methyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 110005115
4-[[6-(methylamino)-3-pyridinyl]methyl]piperazine-2,6-dione
CID 66085785
3-[(2-chloro-4-pyridinyl)methyl]-1,3-diazaspiro[4.6]undecane-2,4-dione
CID 51129751
3-[(4-phenylphenyl)methyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 4825856
7-[[4-(hydroxymethyl)phenyl]methyl]-5,7-diazaspiro[3.4]octane-6,8-dione
CID 110005331
3-[[4-(trifluoromethyl)phenyl]methyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 27247656
5-ethyl-3-[[6-(ethylamino)-3-pyridinyl]methyl]-5-methylimidazolidine-2,4-dione
CID 62207321
1-[[6-(methylamino)-3-pyridinyl]methyl]pyridin-2-one
CID 62208669

Frequently Asked Questions

What is the IUPAC name of 3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione (CID 62207122) is 3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione is CNc1ccc(CN2C(=O)NC3(CCCCC3)C2=O)cn1.
What is the InChIKey of 3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione?
The InChIKey is UPRXCIAHEANXHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-16-12-6-5-11(9-17-12)10-19-13(20)15(18-14(19)21)7-3-2-4-8-15/h5-6,9H,2-4,7-8,10H2,1H3,(H,16,17)(H,18,21).
What are the key properties of 3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione?
3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione has a molecular weight of 288.35 g/mol, XLogP of 1.88, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[6-(methylamino)-3-pyridinyl]methyl]-1,3-diazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 62207122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).