N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine

C13H19N — CID 43632481

IUPACN-ethyl-3-(3-methylphenyl)cyclobutan-1-amine
SMILESCCNC1CC(c2cccc(C)c2)C1
InChIInChI=1S/C13H19N/c1-3-14-13-8-12(9-13)11-6-4-5-10(2)7-11/h4-7,12-14H,3,8-9H2,1-2H3
InChIKeyAUVNGGMTUMERNR-UHFFFAOYSA-N
MW189.30 g/mol
LogP2.85
Rot. Bonds3

About N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine

N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine (PubChem CID 43632481) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-(3-methylphenyl)cyclobutan-1-amine
PubChem CID43632481
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC NameN-ethyl-3-(3-methylphenyl)cyclobutan-1-amine
SMILESCCNC1CC(c2cccc(C)c2)C1
InChIInChI=1S/C13H19N/c1-3-14-13-8-12(9-13)11-6-4-5-10(2)7-11/h4-7,12-14H,3,8-9H2,1-2H3
InChIKeyAUVNGGMTUMERNR-UHFFFAOYSA-N
XLogP2.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,1-diethyl-5-(3-methylphenyl)piperidin-3-amine
CID 83990215
3-(3-methylphenyl)-N-(2-methylpropyl)cyclobutan-1-amine
CID 43632690
3-(3-methylphenyl)-N-[(3-methylphenyl)methyl]cyclobutan-1-amine
CID 43634409
N-[(1-ethylcyclopropyl)methyl]-3-(3-methylphenyl)cyclobutan-1-amine
CID 104530348
N',N'-diethyl-N-[3-(3-methylphenyl)cyclobutyl]ethane-1,2-diamine
CID 43633398
N-(2,2-diethoxyethyl)-3-(3-methylphenyl)cyclobutan-1-amine
CID 79548122
[4-[[[3-(3-methylphenyl)cyclobutyl]amino]methyl]phenyl]methanol
CID 107229953
2-methyl-1-[[3-(3-methylphenyl)cyclobutyl]amino]pentan-2-ol
CID 104530190
N,N,2,2-tetramethyl-N'-[3-(3-methylphenyl)cyclobutyl]propane-1,3-diamine
CID 43633047
N,N-dimethyl-2-[[3-(3-methylphenyl)cyclobutyl]amino]acetamide
CID 43635313
N-(furan-3-ylmethyl)-3-(3-methylphenyl)cyclobutan-1-amine
CID 104528153
N-[(3-methylphenyl)methyl]-3-phenylcyclobutan-1-amine
CID 43632228

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine?
The IUPAC name of N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine (CID 43632481) is N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine.
What is the SMILES notation for N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine?
The canonical SMILES for N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine is CCNC1CC(c2cccc(C)c2)C1.
What is the InChIKey of N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine?
The InChIKey is AUVNGGMTUMERNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-3-14-13-8-12(9-13)11-6-4-5-10(2)7-11/h4-7,12-14H,3,8-9H2,1-2H3.
What are the key properties of N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine?
N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine has a molecular weight of 189.30 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine is sourced from PubChem (CID 43632481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).