1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide

C14H18N4O2S — CID 162506140

IUPAC1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide
SMILESCN1CCC(C(=O)NCc2nnc(-c3cccs3)o2)CC1
InChIInChI=1S/C14H18N4O2S/c1-18-6-4-10(5-7-18)13(19)15-9-12-16-17-14(20-12)11-3-2-8-21-11/h2-3,8,10H,4-7,9H2,1H3,(H,15,19)
InChIKeyHWGMSBPGMGQLMM-UHFFFAOYSA-N
MW306.39 g/mol
LogP1.76
Rot. Bonds4

About 1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide

1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide (PubChem CID 162506140) has the molecular formula C14H18N4O2S and a molecular weight of 306.39 g/mol. Its IUPAC name is 1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide
PubChem CID162506140
Molecular FormulaC14H18N4O2S
Molecular Weight306.39 g/mol
Exact Mass306.12
IUPAC Name1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide
SMILESCN1CCC(C(=O)NCc2nnc(-c3cccs3)o2)CC1
InChIInChI=1S/C14H18N4O2S/c1-18-6-4-10(5-7-18)13(19)15-9-12-16-17-14(20-12)11-3-2-8-21-11/h2-3,8,10H,4-7,9H2,1H3,(H,15,19)
InChIKeyHWGMSBPGMGQLMM-UHFFFAOYSA-N
XLogP1.76
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(4-Methylpiperidin-1-yl)-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone
CID 860214
2-(2,4-Dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-methoxyethyl)-N-{[5-(thiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl}acetamide
CID 16301244
N-methyl-1-phenyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]methanamine
CID 78790965
8-Methyl-3-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]-1,3-diazaspiro[4.5]decane-2,4-dione
CID 2474646
1-Morpholin-4-yl-2-(5-thiophen-2-yl-[1,3,4]oxadiazol-2-ylsulfanyl)-ethanone
CID 865186
N-ethyl-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide
CID 2592834
1-(3-Methyl-piperidin-1-yl)-2-(5-thiophen-2-yl-[1,3,4]oxadiazol-2-ylsulfanyl)-ethanone
CID 3186471
2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-propyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide
CID 25162933
2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-propyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide
CID 25163029
2-(5,7-dihydro-4H-thieno[2,3-c]pyridin-6-ylmethyl)-5-thiophen-2-yl-1,3,4-oxadiazole
CID 71720810
4-[2-[(5-Thiophen-2-yl-1,3,4-oxadiazol-2-yl)methylsulfanyl]ethyl]morpholine
CID 75393578
2-fluoro-N-((5-(thiophen-2-yl)-1,3,4-oxadiazol-2-yl)methyl)benzamide
CID 110322286

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide?
The IUPAC name of 1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide (CID 162506140) is 1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide is CN1CCC(C(=O)NCc2nnc(-c3cccs3)o2)CC1.
What is the InChIKey of 1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide?
The InChIKey is HWGMSBPGMGQLMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2S/c1-18-6-4-10(5-7-18)13(19)15-9-12-16-17-14(20-12)11-3-2-8-21-11/h2-3,8,10H,4-7,9H2,1H3,(H,15,19).
What are the key properties of 1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide?
1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide has a molecular weight of 306.39 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 162506140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).