N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine

C15H23N — CID 81417273

IUPACN-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine
SMILESCCNC1CC(c2ccc(CC)cc2)C1C
InChIInChI=1S/C15H23N/c1-4-12-6-8-13(9-7-12)14-10-15(11(14)3)16-5-2/h6-9,11,14-16H,4-5,10H2,1-3H3
InChIKeyQXOVVYWOPNMVLZ-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.35
Rot. Bonds4

About N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine

N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine (PubChem CID 81417273) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine
PubChem CID81417273
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine
SMILESCCNC1CC(c2ccc(CC)cc2)C1C
InChIInChI=1S/C15H23N/c1-4-12-6-8-13(9-7-12)14-10-15(11(14)3)16-5-2/h6-9,11,14-16H,4-5,10H2,1-3H3
InChIKeyQXOVVYWOPNMVLZ-UHFFFAOYSA-N
XLogP3.35
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(3,4-dimethylphenyl)-N-ethyl-2-methylcyclobutan-1-amine
CID 81417795
N-ethyl-3-(9H-fluoren-2-yl)-2-methylcyclobutan-1-amine
CID 81417064
2-methyl-3-phenyl-N-propylcyclobutan-1-amine
CID 81417285
1-(2-chlorocyclopropyl)-4-ethylbenzene
CID 154973164
N,2-diethyl-3-(4-fluorophenyl)cyclobutan-1-amine
CID 81416943
N,2-diethyl-3-(4-ethylphenyl)-4-methylcyclobutan-1-amine
CID 81423023
N-ethyl-2-(4-propylphenyl)cycloheptan-1-amine
CID 63511493
N-[(4-ethylphenyl)methyl]-2,3-dimethylcyclopentan-1-amine
CID 64907324
3-(4-bromothiophen-2-yl)-N-ethyl-2-methylcyclobutan-1-amine
CID 107355526
1-(2-adamantyl)-N-[(4-ethylphenyl)methyl]methanamine
CID 146000383
N-ethyl-3-phenyl-2-propan-2-ylcyclobutan-1-amine
CID 81421340
2-ethyl-3-(4-ethylphenyl)cyclobutan-1-amine
CID 81415991

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine?
The IUPAC name of N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine (CID 81417273) is N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine.
What is the SMILES notation for N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine?
The canonical SMILES for N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine is CCNC1CC(c2ccc(CC)cc2)C1C.
What is the InChIKey of N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine?
The InChIKey is QXOVVYWOPNMVLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-4-12-6-8-13(9-7-12)14-10-15(11(14)3)16-5-2/h6-9,11,14-16H,4-5,10H2,1-3H3.
What are the key properties of N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine?
N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(4-ethylphenyl)-2-methylcyclobutan-1-amine is sourced from PubChem (CID 81417273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).