2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide

C14H22N4O2S — CID 106637147

IUPAC2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide
SMILESCN(CC(=O)Nc1sccc1C(N)=O)CC1CCCNC1
InChIInChI=1S/C14H22N4O2S/c1-18(8-10-3-2-5-16-7-10)9-12(19)17-14-11(13(15)20)4-6-21-14/h4,6,10,16H,2-3,5,7-9H2,1H3,(H2,15,20)(H,17,19)
InChIKeyCFQSEQZYNOVOHH-UHFFFAOYSA-N
MW310.42 g/mol
LogP0.72
Rot. Bonds6

About 2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide

2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide (PubChem CID 106637147) has the molecular formula C14H22N4O2S and a molecular weight of 310.42 g/mol. Its IUPAC name is 2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide.

Molecular Properties

Compound Name2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide
PubChem CID106637147
Molecular FormulaC14H22N4O2S
Molecular Weight310.42 g/mol
Exact Mass310.15
IUPAC Name2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide
SMILESCN(CC(=O)Nc1sccc1C(N)=O)CC1CCCNC1
InChIInChI=1S/C14H22N4O2S/c1-18(8-10-3-2-5-16-7-10)9-12(19)17-14-11(13(15)20)4-6-21-14/h4,6,10,16H,2-3,5,7-9H2,1H3,(H2,15,20)(H,17,19)
InChIKeyCFQSEQZYNOVOHH-UHFFFAOYSA-N
XLogP0.72
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide
CID 79702062
N-(4-methylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 103815598
N-(2,6-dimethylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 103815623
N-(3,4-dichlorophenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 103815619
N-(3,5-difluorophenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide;hydrochloride
CID 119931387
2-[methyl(piperidin-3-ylmethyl)amino]-N-(2-methylsulfanylphenyl)acetamide;hydrochloride
CID 119929541
N-cyclohexyl-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 106636311
2-[[2-[methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]acetyl]amino]thiophene-3-carboxamide
CID 9117112
ethyl 3-[[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl]-methylamino]propanoate
CID 62011447
2-[[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl]-(carboxymethyl)amino]acetic acid
CID 63646484
N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide
CID 61254641
N-(2-methylbutan-2-yl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 106636496

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide?
The IUPAC name of 2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide (CID 106637147) is 2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide.
What is the SMILES notation for 2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide?
The canonical SMILES for 2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide is CN(CC(=O)Nc1sccc1C(N)=O)CC1CCCNC1.
What is the InChIKey of 2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide?
The InChIKey is CFQSEQZYNOVOHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2S/c1-18(8-10-3-2-5-16-7-10)9-12(19)17-14-11(13(15)20)4-6-21-14/h4,6,10,16H,2-3,5,7-9H2,1H3,(H2,15,20)(H,17,19).
What are the key properties of 2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide?
2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide has a molecular weight of 310.42 g/mol, XLogP of 0.72, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[methyl(piperidin-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide is sourced from PubChem (CID 106637147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).