N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide

C12H18N2OS — CID 66183322

IUPACN-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide
SMILESCCCN(C(=O)Cc1ccsc1)C1CNC1
InChIInChI=1S/C12H18N2OS/c1-2-4-14(11-7-13-8-11)12(15)6-10-3-5-16-9-10/h3,5,9,11,13H,2,4,6-8H2,1H3
InChIKeyNTFWQVXVFHUTSK-UHFFFAOYSA-N
MW238.36 g/mol
LogP1.50
Rot. Bonds5

About N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide

N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide (PubChem CID 66183322) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide.

Molecular Properties

Compound NameN-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide
PubChem CID66183322
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC NameN-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide
SMILESCCCN(C(=O)Cc1ccsc1)C1CNC1
InChIInChI=1S/C12H18N2OS/c1-2-4-14(11-7-13-8-11)12(15)6-10-3-5-16-9-10/h3,5,9,11,13H,2,4,6-8H2,1H3
InChIKeyNTFWQVXVFHUTSK-UHFFFAOYSA-N
XLogP1.50
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-piperidin-4-yl-N-propyl-2-thiophen-3-ylacetamide
CID 60806077
N-(2-bromoethyl)-N-cyclopentyl-2-thiophen-3-ylacetamide
CID 80658598
N-(azetidin-3-yl)-2-(3-chlorophenyl)-N-propylacetamide
CID 66182884
1-(azetidin-3-yl)-2-thiophen-3-ylethanone
CID 116583807
N-(3-chloropropyl)-N-cyclobutyl-2-thiophen-3-ylacetamide
CID 102871977
N-methyl-N-[(3S)-pyrrolidin-3-yl]-2-thiophen-3-ylacetamide
CID 71641161
N-piperidin-3-yl-N-propylthiophene-3-carboxamide
CID 55246454
N-(2-bromoethyl)-N-propyl-2-thiophen-3-ylacetamide
CID 80660414
N-methyl-N-piperidin-4-yl-2-thiophen-3-ylacetamide;hydrochloride
CID 71641436
N-methyl-N-piperidin-3-yl-2-thiophen-3-ylacetamide;hydrochloride
CID 71641261
N-(azetidin-3-yl)-N-ethyl-2-(4-hydroxyphenyl)acetamide
CID 66181882
N,N-diethyl-2-thiophen-3-ylacetamide
CID 60635955

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide?
The IUPAC name of N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide (CID 66183322) is N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide.
What is the SMILES notation for N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide?
The canonical SMILES for N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide is CCCN(C(=O)Cc1ccsc1)C1CNC1.
What is the InChIKey of N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide?
The InChIKey is NTFWQVXVFHUTSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c1-2-4-14(11-7-13-8-11)12(15)6-10-3-5-16-9-10/h3,5,9,11,13H,2,4,6-8H2,1H3.
What are the key properties of N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide?
N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide has a molecular weight of 238.36 g/mol, XLogP of 1.50, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-N-propyl-2-thiophen-3-ylacetamide is sourced from PubChem (CID 66183322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).