N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide

C18H22N2O — CID 102874058

IUPACN-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide
SMILESNCCN(C(=O)Cc1cccc2ccccc12)C1CCC1
InChIInChI=1S/C18H22N2O/c19-11-12-20(16-8-4-9-16)18(21)13-15-7-3-6-14-5-1-2-10-17(14)15/h1-3,5-7,10,16H,4,8-9,11-13,19H2
InChIKeyCBZWFWHNPDRZTI-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.72
Rot. Bonds5

About N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide

N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide (PubChem CID 102874058) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide
PubChem CID102874058
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC NameN-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide
SMILESNCCN(C(=O)Cc1cccc2ccccc12)C1CCC1
InChIInChI=1S/C18H22N2O/c19-11-12-20(16-8-4-9-16)18(21)13-15-7-3-6-14-5-1-2-10-17(14)15/h1-3,5-7,10,16H,4,8-9,11-13,19H2
InChIKeyCBZWFWHNPDRZTI-UHFFFAOYSA-N
XLogP2.72
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-aminoethyl)-N-cyclopentyl-2-(2-hydroxyphenyl)acetamide
CID 80743733
N-(2-aminoethyl)-N-cyclohexyl-2-(2-hydroxyphenyl)acetamide
CID 80740387
N-(2-aminoethyl)-N-ethyl-2-naphthalen-1-ylacetamide
CID 61350278
N-(2-aminoethyl)-N-cyclobutyl-1-hydroxynaphthalene-2-carboxamide
CID 102874121
4-[[cyclopropyl-(2-naphthalen-1-ylacetyl)amino]methyl]benzamide
CID 38363437
N-(2-aminoethyl)-N-cyclobutyl-2-(2,4-difluorophenyl)acetamide
CID 102874077
N-(2-chloroethyl)-N-cyclobutyl-2-(2-fluorophenyl)acetamide
CID 102872699
N-(3-aminopropyl)-N-cyclopropyl-2-(2-hydroxyphenyl)acetamide
CID 80744348
N-(3-aminopropyl)-N-cyclopropyl-2-(2-fluorophenyl)acetamide
CID 43136756
N-cyclopentyl-2-(methylamino)-N-(naphthalen-1-ylmethyl)acetamide;hydrochloride
CID 119773893
N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2-naphthalen-1-ylacetamide
CID 70604955
N-(3-aminopropyl)-2-naphthalen-1-yl-N-propan-2-ylacetamide
CID 43319276

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide?
The IUPAC name of N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide (CID 102874058) is N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide is NCCN(C(=O)Cc1cccc2ccccc12)C1CCC1.
What is the InChIKey of N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide?
The InChIKey is CBZWFWHNPDRZTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c19-11-12-20(16-8-4-9-16)18(21)13-15-7-3-6-14-5-1-2-10-17(14)15/h1-3,5-7,10,16H,4,8-9,11-13,19H2.
What are the key properties of N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide?
N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide has a molecular weight of 282.39 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-cyclobutyl-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 102874058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).