2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide

C21H26N2O — CID 60500149

IUPAC2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide
SMILESCC(c1ccccc1)N(C)CC(=O)NC1(c2ccccc2)CCC1
InChIInChI=1S/C21H26N2O/c1-17(18-10-5-3-6-11-18)23(2)16-20(24)22-21(14-9-15-21)19-12-7-4-8-13-19/h3-8,10-13,17H,9,14-16H2,1-2H3,(H,22,24)
InChIKeyVQIDTYZXGWOOEG-UHFFFAOYSA-N
MW322.45 g/mol
LogP3.88
Rot. Bonds6

About 2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide

2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide (PubChem CID 60500149) has the molecular formula C21H26N2O and a molecular weight of 322.45 g/mol. Its IUPAC name is 2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide.

Molecular Properties

Compound Name2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide
PubChem CID60500149
Molecular FormulaC21H26N2O
Molecular Weight322.45 g/mol
Exact Mass322.20
IUPAC Name2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide
SMILESCC(c1ccccc1)N(C)CC(=O)NC1(c2ccccc2)CCC1
InChIInChI=1S/C21H26N2O/c1-17(18-10-5-3-6-11-18)23(2)16-20(24)22-21(14-9-15-21)19-12-7-4-8-13-19/h3-8,10-13,17H,9,14-16H2,1-2H3,(H,22,24)
InChIKeyVQIDTYZXGWOOEG-UHFFFAOYSA-N
XLogP3.88
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyanocyclopentyl)-2-[methyl(1-phenylethyl)amino]acetamide
CID 51073006
2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(1-phenylcyclobutyl)acetamide
CID 87014095
2-[methyl(1-phenylethyl)amino]-N-phenylacetamide
CID 47109719
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
(2R)-2-amino-N-(1-phenylcyclobutyl)propanamide
CID 119275385
2-hydroxy-2-phenyl-N-(1-phenylcyclobutyl)acetamide
CID 110883240
N,N'-bis(1-phenylcyclopropyl)propanediamide
CID 166301287
2-ethoxy-N-(1-phenylcyclobutyl)acetamide
CID 52571502
N-(1-phenylcyclohexyl)butanamide
CID 110478581
1-methyl-1-phenyl-3-(1-phenylcyclobutyl)urea
CID 110469555
N-(1-phenylcyclopropyl)propanamide
CID 110441332

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide?
The IUPAC name of 2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide (CID 60500149) is 2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide.
What is the SMILES notation for 2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide?
The canonical SMILES for 2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide is CC(c1ccccc1)N(C)CC(=O)NC1(c2ccccc2)CCC1.
What is the InChIKey of 2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide?
The InChIKey is VQIDTYZXGWOOEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O/c1-17(18-10-5-3-6-11-18)23(2)16-20(24)22-21(14-9-15-21)19-12-7-4-8-13-19/h3-8,10-13,17H,9,14-16H2,1-2H3,(H,22,24).
What are the key properties of 2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide?
2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide has a molecular weight of 322.45 g/mol, XLogP of 3.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(1-phenylethyl)amino]-N-(1-phenylcyclobutyl)acetamide is sourced from PubChem (CID 60500149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).