N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide

C13H18N2O — CID 43594870

IUPACN-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)NC2CC(N)C2)cc1
InChIInChI=1S/C13H18N2O/c1-9-2-4-10(5-3-9)6-13(16)15-12-7-11(14)8-12/h2-5,11-12H,6-8,14H2,1H3,(H,15,16)
InChIKeyDIUHXVOEDLQYAK-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.14
Rot. Bonds3

About N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide

N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide (PubChem CID 43594870) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide
PubChem CID43594870
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC NameN-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)NC2CC(N)C2)cc1
InChIInChI=1S/C13H18N2O/c1-9-2-4-10(5-3-9)6-13(16)15-12-7-11(14)8-12/h2-5,11-12H,6-8,14H2,1H3,(H,15,16)
InChIKeyDIUHXVOEDLQYAK-UHFFFAOYSA-N
XLogP1.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-aminocyclobutyl)-2-pyridin-4-ylacetamide
CID 43594929
1-(3-aminocyclobutyl)-3-(4-methylphenyl)urea
CID 43596708
2-(4-methylphenyl)-N-(oxan-4-yl)acetamide
CID 110726863
2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide
CID 43603662
N-[(4-aminocyclohexyl)methyl]-2-(4-methylphenyl)acetamide
CID 106124207
N-[(1R,2R)-2-aminocyclohexyl]-2-(4-methylphenyl)acetamide
CID 93451691
N-[(3aS,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-5-yl]-2-(4-methylphenyl)acetamide
CID 43603845
N-[2-(cyclopentylamino)-2-oxoethyl]-2-(4-methylphenyl)acetamide
CID 112990904
2-(4-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide
CID 113436646
N-(3-aminocyclobutyl)-3-pyridin-4-ylpropanamide
CID 114289940
N-(3,5-dimethylcyclohexyl)-2-(4-sulfanylphenyl)acetamide
CID 107030984
N-(1-tert-butyl-5-oxopyrrolidin-3-yl)-2-(4-methylphenyl)acetamide
CID 110736936

Frequently Asked Questions

What is the IUPAC name of N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide?
The IUPAC name of N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide (CID 43594870) is N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide is Cc1ccc(CC(=O)NC2CC(N)C2)cc1.
What is the InChIKey of N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide?
The InChIKey is DIUHXVOEDLQYAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-9-2-4-10(5-3-9)6-13(16)15-12-7-11(14)8-12/h2-5,11-12H,6-8,14H2,1H3,(H,15,16).
What are the key properties of N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide?
N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide has a molecular weight of 218.30 g/mol, XLogP of 1.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminocyclobutyl)-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 43594870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).