1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine

C17H21N — CID 113488696

IUPAC1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine
SMILESCCC1(NCc2ccc3ccccc3c2)CCC1
InChIInChI=1S/C17H21N/c1-2-17(10-5-11-17)18-13-14-8-9-15-6-3-4-7-16(15)12-14/h3-4,6-9,12,18H,2,5,10-11,13H2,1H3
InChIKeyZWNAMVMSGWJZOX-UHFFFAOYSA-N
MW239.36 g/mol
LogP4.26
Rot. Bonds4

About 1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine

1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine (PubChem CID 113488696) has the molecular formula C17H21N and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine.

Molecular Properties

Compound Name1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine
PubChem CID113488696
Molecular FormulaC17H21N
Molecular Weight239.36 g/mol
Exact Mass239.17
IUPAC Name1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine
SMILESCCC1(NCc2ccc3ccccc3c2)CCC1
InChIInChI=1S/C17H21N/c1-2-17(10-5-11-17)18-13-14-8-9-15-6-3-4-7-16(15)12-14/h3-4,6-9,12,18H,2,5,10-11,13H2,1H3
InChIKeyZWNAMVMSGWJZOX-UHFFFAOYSA-N
XLogP4.26
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[[(1-ethylcyclobutyl)amino]methyl]benzene-1,2-diol
CID 115978682
N-[(3-bromo-4-methylphenyl)methyl]-1-ethylcyclobutan-1-amine
CID 105401701
4-[[(1-ethylcyclobutyl)amino]methyl]phenol
CID 115978684
1-ethyl-N-[[3-(methoxymethyl)phenyl]methyl]cyclobutan-1-amine
CID 113248763
N-[(1-methoxycyclobutyl)methyl]-1-naphthalen-2-ylmethanamine
CID 103991561
N-ethoxy-1-naphthalen-2-ylmethanamine
CID 53308535
[1-(quinolin-6-ylmethylamino)cyclobutyl]methanol
CID 113263671
N-[(2-ethylphenyl)methyl]-1-naphthalen-2-ylmethanamine
CID 64680706
N'-(naphthalen-2-ylmethyl)methanediamine
CID 115225812
(naphthalen-2-ylmethylamino)methanethiol
CID 115228012
N-(naphthalen-2-ylmethyl)-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 79351410
ethane;2-ethylnaphthalene
CID 90684887

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine?
The IUPAC name of 1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine (CID 113488696) is 1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine.
What is the SMILES notation for 1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine?
The canonical SMILES for 1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine is CCC1(NCc2ccc3ccccc3c2)CCC1.
What is the InChIKey of 1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine?
The InChIKey is ZWNAMVMSGWJZOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N/c1-2-17(10-5-11-17)18-13-14-8-9-15-6-3-4-7-16(15)12-14/h3-4,6-9,12,18H,2,5,10-11,13H2,1H3.
What are the key properties of 1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine?
1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine has a molecular weight of 239.36 g/mol, XLogP of 4.26, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine is sourced from PubChem (CID 113488696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).