N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide

C11H16N2OS — CID 66387598

IUPACN-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide
SMILESCC(=O)Nc1ccsc1CNC1CCC1
InChIInChI=1S/C11H16N2OS/c1-8(14)13-10-5-6-15-11(10)7-12-9-3-2-4-9/h5-6,9,12H,2-4,7H2,1H3,(H,13,14)
InChIKeyRDDCMLLUCFHPGK-UHFFFAOYSA-N
MW224.33 g/mol
LogP2.35
Rot. Bonds4

About N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide

N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide (PubChem CID 66387598) has the molecular formula C11H16N2OS and a molecular weight of 224.33 g/mol. Its IUPAC name is N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide.

Molecular Properties

Compound NameN-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide
PubChem CID66387598
Molecular FormulaC11H16N2OS
Molecular Weight224.33 g/mol
Exact Mass224.10
IUPAC NameN-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide
SMILESCC(=O)Nc1ccsc1CNC1CCC1
InChIInChI=1S/C11H16N2OS/c1-8(14)13-10-5-6-15-11(10)7-12-9-3-2-4-9/h5-6,9,12H,2-4,7H2,1H3,(H,13,14)
InChIKeyRDDCMLLUCFHPGK-UHFFFAOYSA-N
XLogP2.35
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[[(4-aminocyclohexyl)amino]methyl]thiophen-3-yl]acetamide
CID 66386996
N-[2-[[(1-cyclopropylpiperidin-4-yl)amino]methyl]thiophen-3-yl]acetamide
CID 66387368
N-[2-[[(3-methoxycyclopentyl)amino]methyl]thiophen-3-yl]acetamide
CID 114117948
N-[2-[[(2-methoxycyclopentyl)amino]methyl]thiophen-3-yl]acetamide
CID 66385192
N-[2-[[(2-methylcycloheptyl)amino]methyl]thiophen-3-yl]acetamide
CID 66386018
N-[2-[(cyclopropylmethylamino)methyl]thiophen-3-yl]acetamide
CID 66384880
N-[2-[(2-cyclohexyloxyethylamino)methyl]thiophen-3-yl]acetamide
CID 66386410
N-[2-[[2-(3-methylcyclohexyl)ethylamino]methyl]thiophen-3-yl]acetamide
CID 66384800
N-[2-[(thian-2-ylmethylamino)methyl]thiophen-3-yl]acetamide
CID 80595252
N-[2-[(2-hydroxyethylamino)methyl]thiophen-3-yl]acetamide
CID 66386722
N-[2-[[3-(hydroxymethyl)pentan-3-ylamino]methyl]thiophen-3-yl]acetamide
CID 66385194
N-[2-[[(3-hydroxy-2,3-dimethylbutan-2-yl)amino]methyl]thiophen-3-yl]acetamide
CID 106186084

Frequently Asked Questions

What is the IUPAC name of N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide?
The IUPAC name of N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide (CID 66387598) is N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide.
What is the SMILES notation for N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide?
The canonical SMILES for N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide is CC(=O)Nc1ccsc1CNC1CCC1.
What is the InChIKey of N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide?
The InChIKey is RDDCMLLUCFHPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS/c1-8(14)13-10-5-6-15-11(10)7-12-9-3-2-4-9/h5-6,9,12H,2-4,7H2,1H3,(H,13,14).
What are the key properties of N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide?
N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide has a molecular weight of 224.33 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(cyclobutylamino)methyl]thiophen-3-yl]acetamide is sourced from PubChem (CID 66387598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).