N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine

C17H21N — CID 69397957

IUPACN-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine
SMILESCCN(C)C1(c2ccc3ccccc3c2)CCC1
InChIInChI=1S/C17H21N/c1-3-18(2)17(11-6-12-17)16-10-9-14-7-4-5-8-15(14)13-16/h4-5,7-10,13H,3,6,11-12H2,1-2H3
InChIKeyIUKPHVDRERLSOM-UHFFFAOYSA-N
MW239.36 g/mol
LogP4.17
Rot. Bonds3

About N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine

N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine (PubChem CID 69397957) has the molecular formula C17H21N and a molecular weight of 239.36 g/mol. Its IUPAC name is N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine.

Molecular Properties

Compound NameN-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine
PubChem CID69397957
Molecular FormulaC17H21N
Molecular Weight239.36 g/mol
Exact Mass239.17
IUPAC NameN-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine
SMILESCCN(C)C1(c2ccc3ccccc3c2)CCC1
InChIInChI=1S/C17H21N/c1-3-18(2)17(11-6-12-17)16-10-9-14-7-4-5-8-15(14)13-16/h4-5,7-10,13H,3,6,11-12H2,1-2H3
InChIKeyIUKPHVDRERLSOM-UHFFFAOYSA-N
XLogP4.17
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1-naphthalen-2-ylcyclobutyl)propan-1-one
CID 174403861
N-methyl-1-(1-naphthalen-2-ylcyclobutyl)methanamine
CID 116963684
2-(1-methylcyclopropyl)naphthalene
CID 10511657
4-ethyl-1-naphthalen-2-ylcycloheptan-1-amine
CID 65082731
N-[(1-naphthalen-2-ylcyclohexyl)methyl]propan-1-amine
CID 146383246
1-(1-naphthalen-2-ylcyclohexyl)propan-1-amine
CID 91217269
4-ethyl-1-naphthalen-2-ylcyclohexan-1-amine
CID 63407775
N,N-dimethyl-1-(1-naphthalen-2-ylcyclohexyl)ethanamine;hydrochloride
CID 53318503
N-methyl-1-(1-naphthalen-2-ylcyclobutyl)ethanamine;hydrochloride
CID 23292615
2-ethyl-2-naphthalen-2-ylazepane
CID 79119079
1-naphthalen-2-ylcyclopropan-1-amine
CID 12982597
N,N-dimethyl-1-[(2R)-2-methyl-1-naphthalen-2-ylcyclopropyl]methanamine
CID 130346820

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine?
The IUPAC name of N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine (CID 69397957) is N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine.
What is the SMILES notation for N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine?
The canonical SMILES for N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine is CCN(C)C1(c2ccc3ccccc3c2)CCC1.
What is the InChIKey of N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine?
The InChIKey is IUKPHVDRERLSOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N/c1-3-18(2)17(11-6-12-17)16-10-9-14-7-4-5-8-15(14)13-16/h4-5,7-10,13H,3,6,11-12H2,1-2H3.
What are the key properties of N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine?
N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine has a molecular weight of 239.36 g/mol, XLogP of 4.17, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-1-naphthalen-2-ylcyclobutan-1-amine is sourced from PubChem (CID 69397957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).