(5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one

C15H21N3O — CID 97490526

IUPAC(5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one
SMILESCc1cccc(CN2CC[C@@]3(CCCNC3)C2=O)n1
InChIInChI=1S/C15H21N3O/c1-12-4-2-5-13(17-12)10-18-9-7-15(14(18)19)6-3-8-16-11-15/h2,4-5,16H,3,6-11H2,1H3/t15-/m1/s1
InChIKeyGEGHJJDCLHOKHA-OAHLLOKOSA-N
MW259.35 g/mol
LogP1.49
Rot. Bonds2

About (5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one

(5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one (PubChem CID 97490526) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is (5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name(5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one
PubChem CID97490526
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name(5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one
SMILESCc1cccc(CN2CC[C@@]3(CCCNC3)C2=O)n1
InChIInChI=1S/C15H21N3O/c1-12-4-2-5-13(17-12)10-18-9-7-15(14(18)19)6-3-8-16-11-15/h2,4-5,16H,3,6-11H2,1H3/t15-/m1/s1
InChIKeyGEGHJJDCLHOKHA-OAHLLOKOSA-N
XLogP1.49
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5S)-9-(cyclopropylmethyl)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one
CID 97372110
9-(6-methylpyridine-2-carbonyl)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one
CID 131651209
9-(2-methylbenzoyl)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one
CID 131679704
(5R)-2-ethyl-2,9-diazaspiro[4.5]decan-1-one
CID 92775014
9-(2-cyclopropylacetyl)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[5.5]undecan-1-one
CID 98897514
2-[(2-chlorophenyl)methyl]-2,9-diazaspiro[4.5]decan-1-one;hydrochloride
CID 45074173
(5S)-9-(5-methylfuran-2-carbonyl)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one
CID 97372108
2-[(6-methyl-2-pyridinyl)methyl]-9-[(1S,5R)-3-oxabicyclo[3.1.0]hexane-6-carbonyl]-2,9-diazaspiro[4.5]decan-1-one
CID 131685243
(5R)-2-[(6-methyl-2-pyridinyl)methyl]-9-(pyridine-2-carbonyl)-2,9-diazaspiro[4.5]decan-1-one
CID 97372107
(5S)-9-(furan-3-carbonyl)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one
CID 97372094
9-[(2-methylpyrazol-3-yl)methyl]-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[5.5]undecan-1-one
CID 98896743
1-[(6-methyl-2-pyridinyl)methyl]imidazolidin-2-one
CID 115370613

Frequently Asked Questions

What is the IUPAC name of (5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one?
The IUPAC name of (5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one (CID 97490526) is (5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for (5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one?
The canonical SMILES for (5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one is Cc1cccc(CN2CC[C@@]3(CCCNC3)C2=O)n1.
What is the InChIKey of (5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one?
The InChIKey is GEGHJJDCLHOKHA-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H21N3O/c1-12-4-2-5-13(17-12)10-18-9-7-15(14(18)19)6-3-8-16-11-15/h2,4-5,16H,3,6-11H2,1H3/t15-/m1/s1.
What are the key properties of (5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one?
(5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one has a molecular weight of 259.35 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-2-[(6-methyl-2-pyridinyl)methyl]-2,9-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 97490526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).