7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one

C19H23N3O — CID 45192042

IUPAC7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one
SMILESCN1CCCC2(CCN(Cc3cccc4ncccc34)C2)C1=O
InChIInChI=1S/C19H23N3O/c1-21-11-4-8-19(18(21)23)9-12-22(14-19)13-15-5-2-7-17-16(15)6-3-10-20-17/h2-3,5-7,10H,4,8-9,11-14H2,1H3
InChIKeyCUOBIGQLENYZMK-UHFFFAOYSA-N
MW309.41 g/mol
LogP2.68
Rot. Bonds2

About 7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one

7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one (PubChem CID 45192042) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is 7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one.

Molecular Properties

Compound Name7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one
PubChem CID45192042
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC Name7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one
SMILESCN1CCCC2(CCN(Cc3cccc4ncccc34)C2)C1=O
InChIInChI=1S/C19H23N3O/c1-21-11-4-8-19(18(21)23)9-12-22(14-19)13-15-5-2-7-17-16(15)6-3-10-20-17/h2-3,5-7,10H,4,8-9,11-14H2,1H3
InChIKeyCUOBIGQLENYZMK-UHFFFAOYSA-N
XLogP2.68
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-[(dimethylamino)methyl]-1-(quinolin-5-ylmethyl)piperidin-3-ol
CID 95897724
(5S)-7-methyl-2-(naphthalen-2-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one
CID 26333138
(5R)-7-[(2,3-dimethoxyphenyl)methyl]-2-(2-pyridin-2-ylethyl)-2,7-diazaspiro[4.5]decan-6-one
CID 126426884
(5S)-2-[(2-amino-3-pyridinyl)methyl]-7-(cyclopropylmethyl)-2,7-diazaspiro[4.5]decan-6-one
CID 97141834
(5S)-7-methyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-2,7-diazaspiro[4.5]decan-6-one
CID 97130544
2-[[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]methyl]-7-methyl-2,7-diazaspiro[4.5]decan-6-one
CID 45220941
7-methyl-2-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-2,7-diazaspiro[4.5]decan-6-one
CID 72895669
3-[3-[(5S)-7-methyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-3-oxopropyl]quinazolin-4-one
CID 95201784
2-[(2,5-dimethoxy-4-methylsulfanylphenyl)methyl]-7-methyl-2,7-diazaspiro[4.5]decan-6-one
CID 72845836
4-(quinolin-5-ylmethyl)-1,4-oxazepane
CID 29183639
(5R)-7-methyl-2-(2-methylquinolin-4-yl)-2,7-diazaspiro[4.5]decan-6-one
CID 97210264
(5S)-7-methyl-2-quinoxalin-2-yl-2,7-diazaspiro[4.5]decan-6-one
CID 97142246

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one?
The IUPAC name of 7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one (CID 45192042) is 7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one.
What is the SMILES notation for 7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one?
The canonical SMILES for 7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one is CN1CCCC2(CCN(Cc3cccc4ncccc34)C2)C1=O.
What is the InChIKey of 7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one?
The InChIKey is CUOBIGQLENYZMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O/c1-21-11-4-8-19(18(21)23)9-12-22(14-19)13-15-5-2-7-17-16(15)6-3-10-20-17/h2-3,5-7,10H,4,8-9,11-14H2,1H3.
What are the key properties of 7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one?
7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one has a molecular weight of 309.41 g/mol, XLogP of 2.68, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-(quinolin-5-ylmethyl)-2,7-diazaspiro[4.5]decan-6-one is sourced from PubChem (CID 45192042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).