(3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone

C17H23N5O2 — CID 72864939

IUPAC(3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone
SMILESCc1noc(C)c1C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2C
InChIInChI=1S/C17H23N5O2/c1-11-14(12(2)24-20-11)16(23)22-8-5-17(6-9-22)15-13(18-10-19-15)4-7-21(17)3/h10H,4-9H2,1-3H3,(H,18,19)
InChIKeyYJKYKOOOBHBCRF-UHFFFAOYSA-N
MW329.40 g/mol
LogP1.63
Rot. Bonds1

About (3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone

(3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone (PubChem CID 72864939) has the molecular formula C17H23N5O2 and a molecular weight of 329.40 g/mol. Its IUPAC name is (3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone.

Molecular Properties

Compound Name(3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone
PubChem CID72864939
Molecular FormulaC17H23N5O2
Molecular Weight329.40 g/mol
Exact Mass329.19
IUPAC Name(3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone
SMILESCc1noc(C)c1C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2C
InChIInChI=1S/C17H23N5O2/c1-11-14(12(2)24-20-11)16(23)22-8-5-17(6-9-22)15-13(18-10-19-15)4-7-21(17)3/h10H,4-9H2,1-3H3,(H,18,19)
InChIKeyYJKYKOOOBHBCRF-UHFFFAOYSA-N
XLogP1.63
TPSA78.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone with MolForge

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Related Compounds

5-Isobutyl-1'-[(5-methylisoxazol-3-yl)carbonyl]-1,5,6,7-tetrahydrospiro[imidazo[4,5-c]pyridine-4,4'-piperidine]
CID 72840440
5-Methyl-1'-(4,5,6,7-tetrahydro-1,2-benzisoxazol-3-ylcarbonyl)-1,5,6,7-tetrahydrospiro[imidazo[4,5-c]pyridine-4,4'-piperidine]
CID 72936585
4-[[4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]methyl]-5-ethyl-3-methyl-1,2-oxazole
CID 136563410
5-ethyl-3-methyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,2-oxazole-4-carboxamide
CID 129006350
5-ethyl-3-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,2-oxazole-4-carboxamide
CID 129341501
5-ethyl-3-methyl-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,2-oxazole-4-carboxamide
CID 129341502
N-{[1-(6-ethyl-5-fluoropyrimidin-4-yl)piperidin-3-yl]methyl}-3,5-dimethylisoxazole-4-carboxamide
CID 131938393
spiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,1'-cyclobutane]-5-yl-[3-(trifluoromethyl)-1,2-oxazol-4-yl]methanone
CID 167962353
5-(Cyclopropylcarbonyl)-1'-[(3-methylisoxazol-5-yl)carbonyl]-1,5,6,7-tetrahydrospiro[imidazo[4,5-c]pyridine-4,4'-piperidine]
CID 72845195
1'-[(3-Methylisoxazol-5-yl)carbonyl]-5-propionyl-1,5,6,7-tetrahydrospiro[imidazo[4,5-c]pyridine-4,4'-piperidine]
CID 72937482
7-[1-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)piperidin-2-yl]-8H-imidazo[1,2-a]pyrimidin-5-one
CID 110118242
3-methyl-6-propan-2-yl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine;5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 160692764

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone?
The IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone (CID 72864939) is (3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone.
What is the SMILES notation for (3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone?
The canonical SMILES for (3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone is Cc1noc(C)c1C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2C.
What is the InChIKey of (3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone?
The InChIKey is YJKYKOOOBHBCRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O2/c1-11-14(12(2)24-20-11)16(23)22-8-5-17(6-9-22)15-13(18-10-19-15)4-7-21(17)3/h10H,4-9H2,1-3H3,(H,18,19).
What are the key properties of (3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone?
(3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone has a molecular weight of 329.40 g/mol, XLogP of 1.63, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethyl-1,2-oxazol-4-yl)-(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)methanone is sourced from PubChem (CID 72864939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).