2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide

C14H22N4O2S — CID 79702062

IUPAC2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide
SMILESCN(CC(=O)Nc1sccc1C(N)=O)CC1CCNCC1
InChIInChI=1S/C14H22N4O2S/c1-18(8-10-2-5-16-6-3-10)9-12(19)17-14-11(13(15)20)4-7-21-14/h4,7,10,16H,2-3,5-6,8-9H2,1H3,(H2,15,20)(H,17,19)
InChIKeyTUPKUXDWRAUTBY-UHFFFAOYSA-N
MW310.42 g/mol
LogP0.72
Rot. Bonds6

About 2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide

2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide (PubChem CID 79702062) has the molecular formula C14H22N4O2S and a molecular weight of 310.42 g/mol. Its IUPAC name is 2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide.

Molecular Properties

Compound Name2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide
PubChem CID79702062
Molecular FormulaC14H22N4O2S
Molecular Weight310.42 g/mol
Exact Mass310.15
IUPAC Name2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide
SMILESCN(CC(=O)Nc1sccc1C(N)=O)CC1CCNCC1
InChIInChI=1S/C14H22N4O2S/c1-18(8-10-2-5-16-6-3-10)9-12(19)17-14-11(13(15)20)4-7-21-14/h4,7,10,16H,2-3,5-6,8-9H2,1H3,(H2,15,20)(H,17,19)
InChIKeyTUPKUXDWRAUTBY-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-4-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-3-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide
CID 106637147
ethyl 3-[[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl]-methylamino]propanoate
CID 62011447
2-[[2-[(5-bromothiophen-2-yl)methyl-methylamino]acetyl]amino]thiophene-3-carboxamide
CID 9299662
2-[[2-[methyl-[(4-propan-2-ylphenyl)methyl]amino]acetyl]amino]thiophene-3-carboxamide
CID 9028907
2-[[2-[methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]acetyl]amino]thiophene-3-carboxamide
CID 9117112
2-[methyl(piperidin-4-ylmethyl)amino]-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride
CID 119930334
N-(2-methoxyphenyl)-2-[methyl(piperidin-4-ylmethyl)amino]acetamide
CID 79702343
N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride
CID 119929550
2-[[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl]-(carboxymethyl)amino]acetic acid
CID 63646484
N-(4-chloro-2-fluorophenyl)-2-[methyl(piperidin-4-ylmethyl)amino]acetamide
CID 79702201
N-(2-chloro-4-methylphenyl)-2-[methyl(piperidin-4-ylmethyl)amino]acetamide
CID 79701270
N-(3-carbamoylthiophen-2-yl)-4-ethylpiperidine-4-carboxamide
CID 55177786

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide?
The IUPAC name of 2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide (CID 79702062) is 2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide.
What is the SMILES notation for 2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide?
The canonical SMILES for 2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide is CN(CC(=O)Nc1sccc1C(N)=O)CC1CCNCC1.
What is the InChIKey of 2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide?
The InChIKey is TUPKUXDWRAUTBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2S/c1-18(8-10-2-5-16-6-3-10)9-12(19)17-14-11(13(15)20)4-7-21-14/h4,7,10,16H,2-3,5-6,8-9H2,1H3,(H2,15,20)(H,17,19).
What are the key properties of 2-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide?
2-[[2-[methyl(piperidin-4-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-4-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide is sourced from PubChem (CID 79702062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).