[4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone

C14H19N5O2 — CID 146138006

IUPAC[4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone
SMILESCc1nonc1C(=O)N1CCC(c2nc(C)c(C)[nH]2)CC1
InChIInChI=1S/C14H19N5O2/c1-8-9(2)16-13(15-8)11-4-6-19(7-5-11)14(20)12-10(3)17-21-18-12/h11H,4-7H2,1-3H3,(H,15,16)
InChIKeyLGHDHMVVVQQEEP-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.74
Rot. Bonds2

About [4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone

[4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone (PubChem CID 146138006) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is [4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone.

Molecular Properties

Compound Name[4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone
PubChem CID146138006
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC Name[4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone
SMILESCc1nonc1C(=O)N1CCC(c2nc(C)c(C)[nH]2)CC1
InChIInChI=1S/C14H19N5O2/c1-8-9(2)16-13(15-8)11-4-6-19(7-5-11)14(20)12-10(3)17-21-18-12/h11H,4-7H2,1-3H3,(H,15,16)
InChIKeyLGHDHMVVVQQEEP-UHFFFAOYSA-N
XLogP1.74
TPSA87.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(4-methyl-1,2,5-oxadiazol-3-yl)-[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methanone
CID 128963906
(3-heptan-4-yl-1,2,3,3a,4,6,7,7a-octahydropyrazolo[4,3-c]pyridin-5-yl)-(4-methyl-1,2,5-oxadiazol-3-yl)methanone
CID 74583616
[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-(3-methylfuran-2-yl)methanone
CID 33119811
[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone
CID 71691416
5-methyl-2-(thian-4-yl)-1H-imidazole-4-carboxylic acid
CID 115035700
(4-methyl-1,2,5-oxadiazol-3-yl)-[4-[2-methyl-5-(trifluoromethyl)benzimidazol-1-yl]piperidin-1-yl]methanone
CID 26362524
ethyl 5-methyl-2-(1-methylsulfonylpiperidin-4-yl)-1H-imidazole-4-carboxylate
CID 138014077
[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-(2-bromo-5-propan-2-yl-1,3-thiazol-4-yl)methanone
CID 71827914
[4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(3-methylpyrazin-2-yl)methanone
CID 136553357
(5-chloro-2-methylpyrimidin-4-yl)-[4-(1H-imidazol-2-yl)piperidin-1-yl]methanone
CID 166214756
3-(4-benzylpiperidine-1-carbonyl)-5,6-dimethyl-1H-pyrazin-2-one
CID 154795486
furan-2-yl-[4-(6-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]methanone
CID 647639

Frequently Asked Questions

What is the IUPAC name of [4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone?
The IUPAC name of [4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone (CID 146138006) is [4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone.
What is the SMILES notation for [4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone?
The canonical SMILES for [4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone is Cc1nonc1C(=O)N1CCC(c2nc(C)c(C)[nH]2)CC1.
What is the InChIKey of [4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone?
The InChIKey is LGHDHMVVVQQEEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O2/c1-8-9(2)16-13(15-8)11-4-6-19(7-5-11)14(20)12-10(3)17-21-18-12/h11H,4-7H2,1-3H3,(H,15,16).
What are the key properties of [4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone?
[4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone has a molecular weight of 289.34 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4,5-dimethyl-1H-imidazol-2-yl)piperidin-1-yl]-(4-methyl-1,2,5-oxadiazol-3-yl)methanone is sourced from PubChem (CID 146138006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).