N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide

C15H22N2O — CID 103735819

IUPACN-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(CNCC2(C)CCC2)cc1
InChIInChI=1S/C15H22N2O/c1-12(18)17-14-6-4-13(5-7-14)10-16-11-15(2)8-3-9-15/h4-7,16H,3,8-11H2,1-2H3,(H,17,18)
InChIKeyABOAJBUHIZHWEJ-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.92
Rot. Bonds5

About N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide

N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide (PubChem CID 103735819) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide
PubChem CID103735819
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(CNCC2(C)CCC2)cc1
InChIInChI=1S/C15H22N2O/c1-12(18)17-14-6-4-13(5-7-14)10-16-11-15(2)8-3-9-15/h4-7,16H,3,8-11H2,1-2H3,(H,17,18)
InChIKeyABOAJBUHIZHWEJ-UHFFFAOYSA-N
XLogP2.92
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[[(1-hydroxycyclohexyl)methylamino]methyl]phenyl]acetamide
CID 62865493
N-[4-[[[1-(hydroxymethyl)cyclopropyl]methylamino]methyl]phenyl]acetamide
CID 79478656
N-[4-[[(1-methylsulfanylcyclobutyl)methylamino]methyl]phenyl]acetamide
CID 107267189
2-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetic acid
CID 114108521
N-[(1-methylcyclobutyl)methyl]-1-phenylmethanamine
CID 103735802
N-[4-[(2-aminoethylamino)methyl]phenyl]acetamide
CID 60887172
N-[4-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenyl]acetamide
CID 79352344
N-[2-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide
CID 103834517
methyl 4-[[(1-methylcyclopropyl)methylamino]methyl]benzoate
CID 103923526
N-[4-[[(4-phenyloxan-4-yl)methylamino]methyl]phenyl]acetamide
CID 38066830
1-(4-cyclopropylphenyl)-N-[(1-methylcyclopentyl)methyl]methanamine
CID 79984608
1-(4-acetylphenyl)-3-[(1-methylcyclobutyl)methyl]urea
CID 103736201

Frequently Asked Questions

What is the IUPAC name of N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide?
The IUPAC name of N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide (CID 103735819) is N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide?
The canonical SMILES for N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide is CC(=O)Nc1ccc(CNCC2(C)CCC2)cc1.
What is the InChIKey of N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide?
The InChIKey is ABOAJBUHIZHWEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12(18)17-14-6-4-13(5-7-14)10-16-11-15(2)8-3-9-15/h4-7,16H,3,8-11H2,1-2H3,(H,17,18).
What are the key properties of N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide?
N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide has a molecular weight of 246.35 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[(1-methylcyclobutyl)methylamino]methyl]phenyl]acetamide is sourced from PubChem (CID 103735819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).