2-[(3-phenylcyclobutyl)amino]-N-propylacetamide

C15H22N2O — CID 43632338

IUPAC2-[(3-phenylcyclobutyl)amino]-N-propylacetamide
SMILESCCCNC(=O)CNC1CC(c2ccccc2)C1
InChIInChI=1S/C15H22N2O/c1-2-8-16-15(18)11-17-14-9-13(10-14)12-6-4-3-5-7-12/h3-7,13-14,17H,2,8-11H2,1H3,(H,16,18)
InChIKeyQKUXUHSFHULMPU-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.05
Rot. Bonds6

About 2-[(3-phenylcyclobutyl)amino]-N-propylacetamide

2-[(3-phenylcyclobutyl)amino]-N-propylacetamide (PubChem CID 43632338) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-[(3-phenylcyclobutyl)amino]-N-propylacetamide.

Molecular Properties

Compound Name2-[(3-phenylcyclobutyl)amino]-N-propylacetamide
PubChem CID43632338
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name2-[(3-phenylcyclobutyl)amino]-N-propylacetamide
SMILESCCCNC(=O)CNC1CC(c2ccccc2)C1
InChIInChI=1S/C15H22N2O/c1-2-8-16-15(18)11-17-14-9-13(10-14)12-6-4-3-5-7-12/h3-7,13-14,17H,2,8-11H2,1H3,(H,16,18)
InChIKeyQKUXUHSFHULMPU-UHFFFAOYSA-N
XLogP2.05
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-2-[(3-phenylcyclobutyl)amino]acetamide
CID 115356209
N-[2-[(3-phenylcyclobutyl)amino]ethyl]acetamide
CID 43632255
2-(4-phenylpiperidin-1-yl)-N-propylacetamide
CID 134001849
2-[[1-(2-phenylethyl)piperidin-4-yl]amino]-N-propylacetamide
CID 119164761
N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide
CID 79386458
N-ethyl-2-[[3-(2-methoxyphenyl)cyclobutyl]amino]acetamide
CID 43635655
3-[[(3-phenylcyclobutyl)amino]methyl]pentan-3-ol
CID 65108444
2-(2-methoxyethylamino)-N-(3-phenylcyclobutyl)acetamide
CID 119774808
4-cyclohexyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 18162781
2-[(2,2-dimethyl-3,4-dihydrochromen-4-yl)amino]-N-propylacetamide
CID 81137654
N'-ethyl-N'-methyl-N-(3-phenylcyclobutyl)ethane-1,2-diamine
CID 55097698
2-[[3-(4-methoxyphenyl)cyclobutyl]amino]-N-methylacetamide
CID 43635290

Frequently Asked Questions

What is the IUPAC name of 2-[(3-phenylcyclobutyl)amino]-N-propylacetamide?
The IUPAC name of 2-[(3-phenylcyclobutyl)amino]-N-propylacetamide (CID 43632338) is 2-[(3-phenylcyclobutyl)amino]-N-propylacetamide.
What is the SMILES notation for 2-[(3-phenylcyclobutyl)amino]-N-propylacetamide?
The canonical SMILES for 2-[(3-phenylcyclobutyl)amino]-N-propylacetamide is CCCNC(=O)CNC1CC(c2ccccc2)C1.
What is the InChIKey of 2-[(3-phenylcyclobutyl)amino]-N-propylacetamide?
The InChIKey is QKUXUHSFHULMPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-2-8-16-15(18)11-17-14-9-13(10-14)12-6-4-3-5-7-12/h3-7,13-14,17H,2,8-11H2,1H3,(H,16,18).
What are the key properties of 2-[(3-phenylcyclobutyl)amino]-N-propylacetamide?
2-[(3-phenylcyclobutyl)amino]-N-propylacetamide has a molecular weight of 246.35 g/mol, XLogP of 2.05, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-phenylcyclobutyl)amino]-N-propylacetamide is sourced from PubChem (CID 43632338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).