N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine

C14H21N — CID 59020082

IUPACN,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine
SMILESCc1ccc(C2(CN(C)C)CCC2)cc1
InChIInChI=1S/C14H21N/c1-12-5-7-13(8-6-12)14(9-4-10-14)11-15(2)3/h5-8H,4,9-11H2,1-3H3
InChIKeyURKNYHQUUVFSOB-UHFFFAOYSA-N
MW203.33 g/mol
LogP2.98
Rot. Bonds3

About N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine

N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine (PubChem CID 59020082) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine
PubChem CID59020082
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC NameN,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine
SMILESCc1ccc(C2(CN(C)C)CCC2)cc1
InChIInChI=1S/C14H21N/c1-12-5-7-13(8-6-12)14(9-4-10-14)11-15(2)3/h5-8H,4,9-11H2,1-3H3
InChIKeyURKNYHQUUVFSOB-UHFFFAOYSA-N
XLogP2.98
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-dimethyl-1-[1-(4-methylphenyl)cyclopentyl]methanamine
CID 21365310
N,N-dimethyl-1-[4-(4-methylphenyl)oxan-4-yl]methanamine
CID 59837374
1-[1-(4-chlorophenyl)cyclobutyl]-N,N-dimethylmethanamine
CID 169436266
1-[1-(4-bromophenyl)cyclobutyl]-N,N-dimethylmethanamine
CID 115049926
4-[1-[(dimethylamino)methyl]cyclopentyl]aniline
CID 115030998
N,N-dimethyl-1-(1-phenylcyclopentyl)methanamine
CID 646439
1-[1-(4-fluorophenyl)cyclohexyl]-N,N-dimethylmethanamine
CID 53324333
N-methyl-N-[[1-(4-methylphenyl)cyclopentyl]methyl]acetamide
CID 59019943
N-methyl-N-[[1-(4-methylphenyl)cyclopropyl]methyl]ethanamine
CID 59019765
1-[1-(4-chlorophenyl)cyclopropyl]-N,N-dimethylmethanamine
CID 21365272
1-[1-(4-bromophenyl)cyclopropyl]-N,N-dimethylmethanamine
CID 68890451
N-[2-[methyl-[[1-(4-methylphenyl)cyclobutyl]methyl]amino]ethyl]formamide
CID 142833148

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine?
The IUPAC name of N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine (CID 59020082) is N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine is Cc1ccc(C2(CN(C)C)CCC2)cc1.
What is the InChIKey of N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine?
The InChIKey is URKNYHQUUVFSOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-12-5-7-13(8-6-12)14(9-4-10-14)11-15(2)3/h5-8H,4,9-11H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine?
N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine has a molecular weight of 203.33 g/mol, XLogP of 2.98, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[1-(4-methylphenyl)cyclobutyl]methanamine is sourced from PubChem (CID 59020082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).