2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide

C13H19N3O — CID 82738136

IUPAC2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide
SMILESCCc1cccnc1CNC(=O)CC1CNC1
InChIInChI=1S/C13H19N3O/c1-2-11-4-3-5-15-12(11)9-16-13(17)6-10-7-14-8-10/h3-5,10,14H,2,6-9H2,1H3,(H,16,17)
InChIKeyWESOACCIFPVRMW-UHFFFAOYSA-N
MW233.31 g/mol
LogP0.87
Rot. Bonds5

About 2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide

2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide (PubChem CID 82738136) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide
PubChem CID82738136
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide
SMILESCCc1cccnc1CNC(=O)CC1CNC1
InChIInChI=1S/C13H19N3O/c1-2-11-4-3-5-15-12(11)9-16-13(17)6-10-7-14-8-10/h3-5,10,14H,2,6-9H2,1H3,(H,16,17)
InChIKeyWESOACCIFPVRMW-UHFFFAOYSA-N
XLogP0.87
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-N-[(3-ethyl-2-pyridinyl)methyl]piperidine-3-carboxamide
CID 82737771
N-[(3-ethyl-2-pyridinyl)methyl]-3-piperidin-3-ylbutanamide
CID 82737570
3-amino-N-[(3-ethyl-2-pyridinyl)methyl]butanamide
CID 82738689
1-cyclopropyl-3-[(3-ethyl-2-pyridinyl)methyl]urea
CID 116657152
2-(3-amino-1,2,4-triazol-1-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide
CID 82741688
2-[2-[[[2-(azetidin-3-yl)acetyl]amino]methyl]phenyl]acetic acid
CID 81318427
N-[(3-ethyl-2-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide
CID 82748805
2-(azetidin-3-yl)-N-[[2-[(dimethylamino)methyl]phenyl]methyl]acetamide
CID 64609566
2-(butan-2-ylamino)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide
CID 82738513
N-[(3-ethyl-2-pyridinyl)methyl]-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide
CID 102893553
N-[(3-ethyl-2-pyridinyl)methyl]-4-propylpiperidine-4-carboxamide
CID 82736217
2-[(3-ethyl-2-pyridinyl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 82732011

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide (CID 82738136) is 2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide is CCc1cccnc1CNC(=O)CC1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide?
The InChIKey is WESOACCIFPVRMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-2-11-4-3-5-15-12(11)9-16-13(17)6-10-7-14-8-10/h3-5,10,14H,2,6-9H2,1H3,(H,16,17).
What are the key properties of 2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide?
2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide has a molecular weight of 233.31 g/mol, XLogP of 0.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-[(3-ethyl-2-pyridinyl)methyl]acetamide is sourced from PubChem (CID 82738136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).