2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide

C15H22N2O2 — CID 81168561

IUPAC2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide
SMILESCC(O)c1ccccc1NC(=O)CC1(CN)CCC1
InChIInChI=1S/C15H22N2O2/c1-11(18)12-5-2-3-6-13(12)17-14(19)9-15(10-16)7-4-8-15/h2-3,5-6,11,18H,4,7-10,16H2,1H3,(H,17,19)
InChIKeyJCXGXCZYEFTVAR-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.20
Rot. Bonds5

About 2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide

2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide (PubChem CID 81168561) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide
PubChem CID81168561
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide
SMILESCC(O)c1ccccc1NC(=O)CC1(CN)CCC1
InChIInChI=1S/C15H22N2O2/c1-11(18)12-5-2-3-6-13(12)17-14(19)9-15(10-16)7-4-8-15/h2-3,5-6,11,18H,4,7-10,16H2,1H3,(H,17,19)
InChIKeyJCXGXCZYEFTVAR-UHFFFAOYSA-N
XLogP2.20
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(aminomethyl)cyclobutyl]-N-(2-methylsulfanylphenyl)acetamide
CID 81179881
2-[1-(aminomethyl)cyclobutyl]-N-(2-propan-2-yloxyphenyl)acetamide
CID 81179451
N-[2-(1-hydroxyethyl)phenyl]-2-[1-(methylamino)cyclohexyl]acetamide
CID 65241986
2-[1-(aminomethyl)cyclohexyl]-N-(2-chlorophenyl)acetamide
CID 104677439
1-amino-N-[2-(1-hydroxyethyl)phenyl]cyclobutane-1-carboxamide
CID 81168462
2-[1-(aminomethyl)cyclobutyl]-N-(2-propoxyphenyl)acetamide
CID 81179040
N-[2-(1-hydroxyethyl)phenyl]butanamide
CID 43508507
2-acetamido-N-[2-(1-hydroxyethyl)phenyl]acetamide
CID 54963204
2-[1-(aminomethyl)cyclobutyl]-N-quinolin-8-ylacetamide
CID 81167252
2-[1-(aminomethyl)cyclobutyl]-N-(5-chloro-2-methylphenyl)acetamide
CID 81178920
2-[1-(aminomethyl)cyclobutyl]-N-(2-ethoxy-4-methylphenyl)acetamide
CID 81173162
2-[1-(aminomethyl)cyclobutyl]-N-(4-ethoxy-2-methylphenyl)acetamide
CID 81172405

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide?
The IUPAC name of 2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide (CID 81168561) is 2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide.
What is the SMILES notation for 2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide?
The canonical SMILES for 2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide is CC(O)c1ccccc1NC(=O)CC1(CN)CCC1.
What is the InChIKey of 2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide?
The InChIKey is JCXGXCZYEFTVAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11(18)12-5-2-3-6-13(12)17-14(19)9-15(10-16)7-4-8-15/h2-3,5-6,11,18H,4,7-10,16H2,1H3,(H,17,19).
What are the key properties of 2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide?
2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide has a molecular weight of 262.35 g/mol, XLogP of 2.20, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)cyclobutyl]-N-[2-(1-hydroxyethyl)phenyl]acetamide is sourced from PubChem (CID 81168561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).