3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide

C14H20N2O — CID 62592961

IUPAC3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide
SMILESNCCc1cccc(C(=O)NCC2CCC2)c1
InChIInChI=1S/C14H20N2O/c15-8-7-11-3-2-6-13(9-11)14(17)16-10-12-4-1-5-12/h2-3,6,9,12H,1,4-5,7-8,10,15H2,(H,16,17)
InChIKeyGVNFKIDNNWIUCX-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.72
Rot. Bonds5

About 3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide

3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide (PubChem CID 62592961) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide.

Molecular Properties

Compound Name3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide
PubChem CID62592961
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide
SMILESNCCc1cccc(C(=O)NCC2CCC2)c1
InChIInChI=1S/C14H20N2O/c15-8-7-11-3-2-6-13(9-11)14(17)16-10-12-4-1-5-12/h2-3,6,9,12H,1,4-5,7-8,10,15H2,(H,16,17)
InChIKeyGVNFKIDNNWIUCX-UHFFFAOYSA-N
XLogP1.72
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-aminoethyl)-N-[(2-methylcyclopentyl)methyl]benzamide
CID 107416397
3-amino-N-(cyclobutylmethyl)benzamide
CID 43298160
3-(2-aminoethyl)-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]benzamide
CID 62593153
3-(2-aminoethyl)-N-cyclohexylbenzamide
CID 62591538
3-(2-aminoethyl)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide
CID 62592616
N-(cyclobutylmethyl)-3-[(Z)-N'-hydroxycarbamimidoyl]benzamide
CID 43298902
3-(2-aminoethyl)-N-benzylbenzamide
CID 62591363
3-(2-aminoethyl)-N-[(1S,2S)-2-hydroxycyclohexyl]benzamide
CID 107211868
3-(chloromethyl)-N-[(3-hydroxycyclohexyl)methyl]benzamide
CID 106127994
N-(cyclobutylmethyl)-3-[(2,5-dioxoimidazolidin-1-yl)methyl]benzamide
CID 33381394
N-(cyclopentylmethyl)-3-[(Z)-N'-hydroxycarbamimidoyl]benzamide
CID 43371334
3-amino-N-(cyclobutylmethyl)-4-fluorobenzamide
CID 43437026

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide?
The IUPAC name of 3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide (CID 62592961) is 3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide.
What is the SMILES notation for 3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide?
The canonical SMILES for 3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide is NCCc1cccc(C(=O)NCC2CCC2)c1.
What is the InChIKey of 3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide?
The InChIKey is GVNFKIDNNWIUCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c15-8-7-11-3-2-6-13(9-11)14(17)16-10-12-4-1-5-12/h2-3,6,9,12H,1,4-5,7-8,10,15H2,(H,16,17).
What are the key properties of 3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide?
3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide has a molecular weight of 232.33 g/mol, XLogP of 1.72, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-N-(cyclobutylmethyl)benzamide is sourced from PubChem (CID 62592961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).