7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide

C19H24N4O2 — CID 139009201

IUPAC7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide
SMILESCN1CCC2(CCN(C(=O)NCc3cc(-c4ccccc4)no3)C2)C1
InChIInChI=1S/C19H24N4O2/c1-22-9-7-19(13-22)8-10-23(14-19)18(24)20-12-16-11-17(21-25-16)15-5-3-2-4-6-15/h2-6,11H,7-10,12-14H2,1H3,(H,20,24)
InChIKeyZNIDNUKGZNZDHX-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.58
Rot. Bonds3

About 7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide

7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide (PubChem CID 139009201) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide.

Molecular Properties

Compound Name7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide
PubChem CID139009201
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide
SMILESCN1CCC2(CCN(C(=O)NCc3cc(-c4ccccc4)no3)C2)C1
InChIInChI=1S/C19H24N4O2/c1-22-9-7-19(13-22)8-10-23(14-19)18(24)20-12-16-11-17(21-25-16)15-5-3-2-4-6-15/h2-6,11H,7-10,12-14H2,1H3,(H,20,24)
InChIKeyZNIDNUKGZNZDHX-UHFFFAOYSA-N
XLogP2.58
TPSA61.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide with MolForge

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Related Compounds

N-benzyl-2-methyl-7-oxa-2,10-diazaspiro[4.6]undecane-10-carboxamide
CID 131644499
1-[3-[(3-phenyl-1,2-oxazol-5-yl)methyl]-3-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]ethanone
CID 110129866
(3S)-3-[(2-methylimidazol-1-yl)methyl]-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidine-1-carboxamide
CID 126449505
(3R)-3-[(2-methylimidazol-1-yl)methyl]-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidine-1-carboxamide
CID 126449506
2-[(3-phenyl-1,2-oxazol-5-yl)methylcarbamoyl]cyclobutane-1-carboxylic acid
CID 120977205
(3-phenyl-1,2-oxazol-5-yl)methyl 1-acetyl-4-phenylpiperidine-4-carboxylate
CID 37143786
(3S)-N-ethyl-1-ethylsulfonyl-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidine-3-carboxamide
CID 51595538
4-(furan-2-carbonyl)-N'-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperazine-1-carboximidamide;hydroiodide
CID 119130370
(3S)-1-(cyclopropanecarbonyl)-N-ethyl-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidine-3-carboxamide
CID 95855480
3-hydroxy-9,9-dimethyl-4-oxo-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-6,7-dihydropyrimido[2,1-c][1,4]oxazine-2-carboxamide
CID 54735196
N-ethyl-1-methyl-3-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]methyl]piperidine-3-carboxamide
CID 46974043
N',3-dimethyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidine-1-carboximidamide
CID 119130050

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide?
The IUPAC name of 7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide (CID 139009201) is 7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide.
What is the SMILES notation for 7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide?
The canonical SMILES for 7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide is CN1CCC2(CCN(C(=O)NCc3cc(-c4ccccc4)no3)C2)C1.
What is the InChIKey of 7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide?
The InChIKey is ZNIDNUKGZNZDHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-22-9-7-19(13-22)8-10-23(14-19)18(24)20-12-16-11-17(21-25-16)15-5-3-2-4-6-15/h2-6,11H,7-10,12-14H2,1H3,(H,20,24).
What are the key properties of 7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide?
7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-2,7-diazaspiro[4.4]nonane-2-carboxamide is sourced from PubChem (CID 139009201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).