2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide

C17H25N3O2 — CID 87014095

IUPAC2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide
SMILESCN(CC(=O)NC1(c2ccccc2)CCC1)CC(=O)N(C)C
InChIInChI=1S/C17H25N3O2/c1-19(2)16(22)13-20(3)12-15(21)18-17(10-7-11-17)14-8-5-4-6-9-14/h4-6,8-9H,7,10-13H2,1-3H3,(H,18,21)
InChIKeyAAURVBARTMICPZ-UHFFFAOYSA-N
MW303.41 g/mol
LogP1.20
Rot. Bonds6

About 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide

2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide (PubChem CID 87014095) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide.

Molecular Properties

Compound Name2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide
PubChem CID87014095
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC Name2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide
SMILESCN(CC(=O)NC1(c2ccccc2)CCC1)CC(=O)N(C)C
InChIInChI=1S/C17H25N3O2/c1-19(2)16(22)13-20(3)12-15(21)18-17(10-7-11-17)14-8-5-4-6-9-14/h4-6,8-9H,7,10-13H2,1-3H3,(H,18,21)
InChIKeyAAURVBARTMICPZ-UHFFFAOYSA-N
XLogP1.20
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 34557487
2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide
CID 60500149
2-ethoxy-N-(1-phenylcyclobutyl)acetamide
CID 52571502
2-[methyl(thiophen-2-ylsulfonyl)amino]-N-(1-phenylcyclobutyl)acetamide
CID 51273162
2-[[2-oxo-2-[(1-phenylcyclobutyl)amino]ethyl]-propylamino]-N-propylacetamide
CID 87018492
N,N'-bis(1-phenylcyclopropyl)propanediamide
CID 166301287
1-methyl-1-phenyl-3-(1-phenylcyclobutyl)urea
CID 110469555
N-(1-phenylcyclohexyl)butanamide
CID 110478581
1,1-dimethyl-3-(1-phenylcyclopropyl)urea
CID 11217964
N-(1-phenylcyclopropyl)propanamide
CID 110441332
4-oxo-4-[(1-phenylcyclopentyl)amino]butanoic acid
CID 110442749
2-cyclohexyl-N-(1-phenylcyclobutyl)acetamide
CID 55461959

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide?
The IUPAC name of 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide (CID 87014095) is 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide.
What is the SMILES notation for 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide?
The canonical SMILES for 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide is CN(CC(=O)NC1(c2ccccc2)CCC1)CC(=O)N(C)C.
What is the InChIKey of 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide?
The InChIKey is AAURVBARTMICPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-19(2)16(22)13-20(3)12-15(21)18-17(10-7-11-17)14-8-5-4-6-9-14/h4-6,8-9H,7,10-13H2,1-3H3,(H,18,21).
What are the key properties of 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide?
2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide has a molecular weight of 303.41 g/mol, XLogP of 1.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide is sourced from PubChem (CID 87014095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).