3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide

C14H22N2OS — CID 107068069

IUPAC3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide
SMILESCc1ccc(C(C)NC(=O)C2NCCCC2C)s1
InChIInChI=1S/C14H22N2OS/c1-9-5-4-8-15-13(9)14(17)16-11(3)12-7-6-10(2)18-12/h6-7,9,11,13,15H,4-5,8H2,1-3H3,(H,16,17)
InChIKeyIXWHDINGPAYALC-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.62
Rot. Bonds3

About 3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide

3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide (PubChem CID 107068069) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is 3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide
PubChem CID107068069
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC Name3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide
SMILESCc1ccc(C(C)NC(=O)C2NCCCC2C)s1
InChIInChI=1S/C14H22N2OS/c1-9-5-4-8-15-13(9)14(17)16-11(3)12-7-6-10(2)18-12/h6-7,9,11,13,15H,4-5,8H2,1-3H3,(H,16,17)
InChIKeyIXWHDINGPAYALC-UHFFFAOYSA-N
XLogP2.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(5-chlorothiophen-2-yl)ethyl]-3-methylpiperidine-2-carboxamide
CID 107067368
N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide
CID 54953950
(3S)-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-3-carboxamide
CID 81140632
3-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-2-carboxamide
CID 107068241
N-[(1R)-1-(2-bromophenyl)ethyl]-3-methylpiperidine-2-carboxamide
CID 107068435
cis-(1S,3R)-3-[1-(5-methylthiophen-2-yl)ethylcarbamoyl]cyclopentane-1-carboxylic acid
CID 114092124
N-[1-(3-chlorophenyl)ethyl]-3-methylpiperidine-2-carboxamide
CID 107067843
3-methyl-N-[1-(4-methylphenyl)propyl]piperidine-2-carboxamide
CID 107067400
3-methyl-N-(3-methyl-1-phenylbutyl)piperidine-2-carboxamide
CID 107067392
2-[(3-methylpiperidine-2-carbonyl)amino]-2-phenylacetic acid
CID 107067870
3-methyl-N-[1-(methylamino)-1-oxopropan-2-yl]piperidine-2-carboxamide
CID 62340143
1-(5-methylthiophen-2-yl)ethylurea
CID 61356567

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide?
The IUPAC name of 3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide (CID 107068069) is 3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide?
The canonical SMILES for 3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide is Cc1ccc(C(C)NC(=O)C2NCCCC2C)s1.
What is the InChIKey of 3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide?
The InChIKey is IXWHDINGPAYALC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-9-5-4-8-15-13(9)14(17)16-11(3)12-7-6-10(2)18-12/h6-7,9,11,13,15H,4-5,8H2,1-3H3,(H,16,17).
What are the key properties of 3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide?
3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide has a molecular weight of 266.41 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]piperidine-2-carboxamide is sourced from PubChem (CID 107068069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).