2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide

C17H33N3O — CID 66215693

IUPAC2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide
SMILESCCCN(CC(=O)N(C(C)C)C1CCCCC1)C1CNC1
InChIInChI=1S/C17H33N3O/c1-4-10-19(16-11-18-12-16)13-17(21)20(14(2)3)15-8-6-5-7-9-15/h14-16,18H,4-13H2,1-3H3
InChIKeyJJLLKNRNZBNJDM-UHFFFAOYSA-N
MW295.47 g/mol
LogP2.24
Rot. Bonds7

About 2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide

2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide (PubChem CID 66215693) has the molecular formula C17H33N3O and a molecular weight of 295.47 g/mol. Its IUPAC name is 2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide
PubChem CID66215693
Molecular FormulaC17H33N3O
Molecular Weight295.47 g/mol
Exact Mass295.26
IUPAC Name2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide
SMILESCCCN(CC(=O)N(C(C)C)C1CCCCC1)C1CNC1
InChIInChI=1S/C17H33N3O/c1-4-10-19(16-11-18-12-16)13-17(21)20(14(2)3)15-8-6-5-7-9-15/h14-16,18H,4-13H2,1-3H3
InChIKeyJJLLKNRNZBNJDM-UHFFFAOYSA-N
XLogP2.24
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-2-[ethyl(pyrrolidin-3-yl)amino]-N-propan-2-ylacetamide
CID 63299179
2-[azetidin-3-yl(propyl)amino]-N-methyl-N-propan-2-ylacetamide
CID 66214520
2-[azetidin-3-yl(propyl)amino]-N,N-dimethylacetamide
CID 62784248
2-[cyclododecyl(propyl)amino]acetic acid
CID 65064979
N-cyclohexyl-N-propylazetidin-3-amine
CID 66183284
2-[azetidin-3-yl(propyl)amino]-N-cyclopropylacetamide
CID 66216105
N,N'-dicyclohexyl-N,N'-di(propan-2-yl)dodecanediamide
CID 20752266
2-chloro-N-cyclopentyl-N-propan-2-ylacetamide
CID 54592476
N-ethyl-2-[piperidin-3-yl(propyl)amino]acetamide
CID 63638025
2-[azetidin-3-yl(propyl)amino]-N-(2,3-dimethylcyclohexyl)acetamide
CID 66213902
N-propan-2-yl-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921653
N-(2-methylprop-2-enyl)-N-propylazetidin-3-amine
CID 66215524

Frequently Asked Questions

What is the IUPAC name of 2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide?
The IUPAC name of 2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide (CID 66215693) is 2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide is CCCN(CC(=O)N(C(C)C)C1CCCCC1)C1CNC1.
What is the InChIKey of 2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide?
The InChIKey is JJLLKNRNZBNJDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O/c1-4-10-19(16-11-18-12-16)13-17(21)20(14(2)3)15-8-6-5-7-9-15/h14-16,18H,4-13H2,1-3H3.
What are the key properties of 2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide?
2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide has a molecular weight of 295.47 g/mol, XLogP of 2.24, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[azetidin-3-yl(propyl)amino]-N-cyclohexyl-N-propan-2-ylacetamide is sourced from PubChem (CID 66215693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).