3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide

C14H19N3O3 — CID 118793810

IUPAC3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide
SMILESNCCOc1cccc(C(=O)NCC(=O)NC2CC2)c1
InChIInChI=1S/C14H19N3O3/c15-6-7-20-12-3-1-2-10(8-12)14(19)16-9-13(18)17-11-4-5-11/h1-3,8,11H,4-7,9,15H2,(H,16,19)(H,17,18)
InChIKeyVNSYRDOAHKZCLU-UHFFFAOYSA-N
MW277.32 g/mol
LogP0.03
Rot. Bonds7

About 3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide

3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide (PubChem CID 118793810) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is 3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide
PubChem CID118793810
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide
SMILESNCCOc1cccc(C(=O)NCC(=O)NC2CC2)c1
InChIInChI=1S/C14H19N3O3/c15-6-7-20-12-3-1-2-10(8-12)14(19)16-9-13(18)17-11-4-5-11/h1-3,8,11H,4-7,9,15H2,(H,16,19)(H,17,18)
InChIKeyVNSYRDOAHKZCLU-UHFFFAOYSA-N
XLogP0.03
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 50.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-aminoethyl)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide
CID 62592616
3-carbamothioyl-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide
CID 43568522
N-cyclopropyl-3-[2-oxo-2-(2-phenoxyethylamino)ethoxy]benzamide
CID 60522738
2-(aminomethyl)-N-[2-(cyclopropylamino)-2-oxoethyl]pyridine-4-carboxamide
CID 113277733
N-[(3R,3aR,6R,6aR)-6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]-3-(2-aminoethoxy)benzamide;hydrochloride
CID 155972251
4-[[3-(3-methoxypropoxy)benzoyl]amino]cyclohexane-1-carboxylic acid
CID 119229681
N-(2-aminoethyl)-3-(2-methoxyethoxy)benzamide
CID 119381991
N-cyclohexyl-3-propoxybenzamide
CID 4960053
4-butoxy-N-[2-[(4-methylcyclohexyl)amino]-2-oxoethyl]benzamide
CID 24982875
N-(4-bromocyclohexyl)-3-propoxybenzamide
CID 114308980
2-[[2-[(3-propoxybenzoyl)amino]acetyl]amino]acetic acid
CID 62919842
3-(fluoromethoxy)-N-[2-[[(3R)-1-(oxan-4-yl)pyrrolidin-3-yl]amino]-2-oxoethyl]benzamide
CID 70671899

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide?
The IUPAC name of 3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide (CID 118793810) is 3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide.
What is the SMILES notation for 3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide?
The canonical SMILES for 3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide is NCCOc1cccc(C(=O)NCC(=O)NC2CC2)c1.
What is the InChIKey of 3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide?
The InChIKey is VNSYRDOAHKZCLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c15-6-7-20-12-3-1-2-10(8-12)14(19)16-9-13(18)17-11-4-5-11/h1-3,8,11H,4-7,9,15H2,(H,16,19)(H,17,18).
What are the key properties of 3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide?
3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide has a molecular weight of 277.32 g/mol, XLogP of 0.03, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide is sourced from PubChem (CID 118793810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).