N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide

C15H22N2O2S — CID 115880664

IUPACN-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)NCC(=O)NC2CCC(C)(C)C2)s1
InChIInChI=1S/C15H22N2O2S/c1-10-4-5-12(20-10)14(19)16-9-13(18)17-11-6-7-15(2,3)8-11/h4-5,11H,6-9H2,1-3H3,(H,16,19)(H,17,18)
InChIKeyFMRRWYPXYJGWIY-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.48
Rot. Bonds4

About N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide

N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide (PubChem CID 115880664) has the molecular formula C15H22N2O2S and a molecular weight of 294.42 g/mol. Its IUPAC name is N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide
PubChem CID115880664
Molecular FormulaC15H22N2O2S
Molecular Weight294.42 g/mol
Exact Mass294.14
IUPAC NameN-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)NCC(=O)NC2CCC(C)(C)C2)s1
InChIInChI=1S/C15H22N2O2S/c1-10-4-5-12(20-10)14(19)16-9-13(18)17-11-6-7-15(2,3)8-11/h4-5,11H,6-9H2,1-3H3,(H,16,19)(H,17,18)
InChIKeyFMRRWYPXYJGWIY-UHFFFAOYSA-N
XLogP2.48
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-N-[2-[(3-methylcyclopentyl)amino]-2-oxoethyl]thiophene-2-carboxamide
CID 114549809
[2-(cyclooctylamino)-2-oxoethyl] 2-[(5-methylthiophene-2-carbonyl)amino]acetate
CID 4271051
N-[2-[[1-(hydroxymethyl)cyclopentyl]methylamino]-2-oxoethyl]-5-methylthiophene-2-carboxamide
CID 115362304
2-cyclopropyl-2-[[2-[(5-methylthiophene-2-carbonyl)amino]acetyl]amino]acetic acid
CID 62694994
2-[1-[[2-[(5-methylthiophene-2-carbonyl)amino]acetyl]amino]cyclobutyl]acetic acid
CID 79844424
N-[2-(2-acetylhydrazinyl)-2-oxoethyl]-5-methylthiophene-2-carboxamide
CID 30905433
5-methyl-N-[2-oxo-2-[(1-phenylcyclobutyl)methylamino]ethyl]thiophene-2-carboxamide
CID 18139468
N-(3,3-dimethylcyclopentyl)-2-(propan-2-ylamino)acetamide
CID 114546396
N-[2-[[(2R)-1-hydroxypropan-2-yl]amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide
CID 79031640
N-[2-(2-bromoprop-2-enylamino)-2-oxoethyl]-5-methylthiophene-2-carboxamide
CID 47439179
N-(3,3-dimethylcyclopentyl)-2-(2-hydroxyphenyl)acetamide
CID 113345738
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-5-methylthiophene-2-carboxamide
CID 65118919

Frequently Asked Questions

What is the IUPAC name of N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide?
The IUPAC name of N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide (CID 115880664) is N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide is Cc1ccc(C(=O)NCC(=O)NC2CCC(C)(C)C2)s1.
What is the InChIKey of N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide?
The InChIKey is FMRRWYPXYJGWIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2S/c1-10-4-5-12(20-10)14(19)16-9-13(18)17-11-6-7-15(2,3)8-11/h4-5,11H,6-9H2,1-3H3,(H,16,19)(H,17,18).
What are the key properties of N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide?
N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide has a molecular weight of 294.42 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(3,3-dimethylcyclopentyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 115880664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).