4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide

C11H20N2OS — CID 103063009

IUPAC4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide
SMILESCC1CCNC(C(=O)NC2CCSC2)C1
InChIInChI=1S/C11H20N2OS/c1-8-2-4-12-10(6-8)11(14)13-9-3-5-15-7-9/h8-10,12H,2-7H2,1H3,(H,13,14)
InChIKeyIIZYXHMSIZMXKD-UHFFFAOYSA-N
MW228.36 g/mol
LogP1.00
Rot. Bonds2

About 4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide

4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide (PubChem CID 103063009) has the molecular formula C11H20N2OS and a molecular weight of 228.36 g/mol. Its IUPAC name is 4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide
PubChem CID103063009
Molecular FormulaC11H20N2OS
Molecular Weight228.36 g/mol
Exact Mass228.13
IUPAC Name4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide
SMILESCC1CCNC(C(=O)NC2CCSC2)C1
InChIInChI=1S/C11H20N2OS/c1-8-2-4-12-10(6-8)11(14)13-9-3-5-15-7-9/h8-10,12H,2-7H2,1H3,(H,13,14)
InChIKeyIIZYXHMSIZMXKD-UHFFFAOYSA-N
XLogP1.00
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylcyclohexyl)thiomorpholine-3-carboxamide
CID 82905560
N-(1-cyclopropylpiperidin-4-yl)-4-methylpiperidine-2-carboxamide
CID 114423145
N-(2,2-diethyloxan-4-yl)-4-methylpiperidine-2-carboxamide
CID 114424424
4-methyl-N-methylsulfonylpiperidine-2-carboxamide
CID 103287766
4-methylpiperidine-2-carbohydrazide
CID 114424068
N-(1,1-dioxothian-3-yl)-4-methylpiperidine-2-carboxamide
CID 114424060
N-(1-cyclopropylpyrrolidin-3-yl)-4-methylpiperidine-2-carboxamide
CID 114423855
4-methyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidine-2-carboxamide
CID 114422931
4-methyl-N-(2-methyloxolan-3-yl)piperidine-2-carboxamide
CID 114424400
N-(thian-4-yl)pyrrolidine-2-carboxamide
CID 115626530
N',N',4-trimethylpiperidine-2-carbohydrazide
CID 114424419
N-(1-cyclopropylethyl)-4-methylpiperidine-2-carboxamide
CID 114422825

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide?
The IUPAC name of 4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide (CID 103063009) is 4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide.
What is the SMILES notation for 4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide?
The canonical SMILES for 4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide is CC1CCNC(C(=O)NC2CCSC2)C1.
What is the InChIKey of 4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide?
The InChIKey is IIZYXHMSIZMXKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2OS/c1-8-2-4-12-10(6-8)11(14)13-9-3-5-15-7-9/h8-10,12H,2-7H2,1H3,(H,13,14).
What are the key properties of 4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide?
4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide has a molecular weight of 228.36 g/mol, XLogP of 1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(thiolan-3-yl)piperidine-2-carboxamide is sourced from PubChem (CID 103063009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).