N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide

C11H21N3O — CID 64612464

IUPACN-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide
SMILESNC1CCC(NC(=O)CC2CNC2)CC1
InChIInChI=1S/C11H21N3O/c12-9-1-3-10(4-2-9)14-11(15)5-8-6-13-7-8/h8-10,13H,1-7,12H2,(H,14,15)
InChIKeyJSLKSDWBZKXJGS-UHFFFAOYSA-N
MW211.31 g/mol
LogP-0.02
Rot. Bonds3

About N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide

N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide (PubChem CID 64612464) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide
PubChem CID64612464
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC NameN-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide
SMILESNC1CCC(NC(=O)CC2CNC2)CC1
InChIInChI=1S/C11H21N3O/c12-9-1-3-10(4-2-9)14-11(15)5-8-6-13-7-8/h8-10,13H,1-7,12H2,(H,14,15)
InChIKeyJSLKSDWBZKXJGS-UHFFFAOYSA-N
XLogP-0.02
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-aminocyclopentyl)-N-(azetidin-3-yl)acetamide;hydrochloride
CID 130690591
2-(4-aminocyclohexyl)-N-(4-ethylcyclohexyl)acetamide
CID 62782919
2-(azetidin-3-yl)-N-cyclopropylacetamide;2-(1-methylazetidin-3-yl)acetic acid;hydrochloride
CID 160590199
2-(azetidin-3-yl)-N-(3-methylcyclobutyl)acetamide
CID 115739761
2-(azetidin-3-yl)-N-(1-tert-butylpiperidin-4-yl)acetamide
CID 64609725
2-(azetidin-3-yl)-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 64618765
2-(azetidin-3-yl)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]acetamide
CID 64617968
3-[[2-(azetidin-3-yl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 64610824
N-(3-aminocyclopentyl)-2-cyclopentylacetamide
CID 115272899
2-(azetidin-3-yl)-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)acetamide
CID 65471237
2-(azetidin-3-yl)-N-hydroxyacetamide
CID 64611037
N-cyclopentyl-2-cyclopropylacetamide
CID 60753480

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide?
The IUPAC name of N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide (CID 64612464) is N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide?
The canonical SMILES for N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide is NC1CCC(NC(=O)CC2CNC2)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide?
The InChIKey is JSLKSDWBZKXJGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c12-9-1-3-10(4-2-9)14-11(15)5-8-6-13-7-8/h8-10,13H,1-7,12H2,(H,14,15).
What are the key properties of N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide?
N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide has a molecular weight of 211.31 g/mol, XLogP of -0.02, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-(azetidin-3-yl)acetamide is sourced from PubChem (CID 64612464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).