N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine

C16H25NO — CID 62594810

IUPACN-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine
SMILESCNCC1(c2ccc(OCC(C)C)cc2)CCC1
InChIInChI=1S/C16H25NO/c1-13(2)11-18-15-7-5-14(6-8-15)16(12-17-3)9-4-10-16/h5-8,13,17H,4,9-12H2,1-3H3
InChIKeyOOSZXIVOSPDMTQ-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.36
Rot. Bonds6

About N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine

N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine (PubChem CID 62594810) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine
PubChem CID62594810
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC NameN-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine
SMILESCNCC1(c2ccc(OCC(C)C)cc2)CCC1
InChIInChI=1S/C16H25NO/c1-13(2)11-18-15-7-5-14(6-8-15)16(12-17-3)9-4-10-16/h5-8,13,17H,4,9-12H2,1-3H3
InChIKeyOOSZXIVOSPDMTQ-UHFFFAOYSA-N
XLogP3.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine 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-[[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methyl]cyclopropanamine
CID 62595731
N-methyl-1-[1-(4-propoxyphenyl)cyclopropyl]methanamine
CID 112517810
1-[1-(4-butan-2-ylphenyl)cyclobutyl]-N-methylmethanamine
CID 116963591
4-(2-methylpropoxy)-N-[(1-phenylcyclopentyl)methyl]benzamide
CID 1120192
1-[1-(4-fluorophenyl)cyclohexyl]-N-methylmethanamine
CID 58954797
N-methyl-1-(1-naphthalen-2-ylcyclobutyl)methanamine
CID 116963684
1-[4-(2-methylpropoxy)phenyl]cyclohexane-1-carbonitrile
CID 28937692
1-[[1-[4-(2-methylpropoxy)phenyl]ethylamino]methyl]cyclopentan-1-ol
CID 65107204
[1-[1-[4-(2-methylpropoxy)phenyl]ethylamino]cyclobutyl]methanol
CID 115927986
[3-tert-butyl-1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine
CID 65016920
N-[[1-(4-methoxyphenyl)cyclobutyl]methyl]-2-methylpropanamide
CID 110478485
N-[[1-(4-ethoxyphenyl)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 63510236

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine?
The IUPAC name of N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine (CID 62594810) is N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine.
What is the SMILES notation for N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine?
The canonical SMILES for N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine is CNCC1(c2ccc(OCC(C)C)cc2)CCC1.
What is the InChIKey of N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine?
The InChIKey is OOSZXIVOSPDMTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-13(2)11-18-15-7-5-14(6-8-15)16(12-17-3)9-4-10-16/h5-8,13,17H,4,9-12H2,1-3H3.
What are the key properties of N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine?
N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine has a molecular weight of 247.38 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-[4-(2-methylpropoxy)phenyl]cyclobutyl]methanamine is sourced from PubChem (CID 62594810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).