N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide

C14H20N2O2 — CID 61349951

IUPACN-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)N(CCN)C1CC1
InChIInChI=1S/C14H20N2O2/c1-2-18-13-6-4-3-5-12(13)14(17)16(10-9-15)11-7-8-11/h3-6,11H,2,7-10,15H2,1H3
InChIKeyXMJVFCDTXRNXQT-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.65
Rot. Bonds6

About N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide

N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide (PubChem CID 61349951) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide
PubChem CID61349951
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)N(CCN)C1CC1
InChIInChI=1S/C14H20N2O2/c1-2-18-13-6-4-3-5-12(13)14(17)16(10-9-15)11-7-8-11/h3-6,11H,2,7-10,15H2,1H3
InChIKeyXMJVFCDTXRNXQT-UHFFFAOYSA-N
XLogP1.65
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromoethyl)-N-cyclopentyl-2-ethoxybenzamide
CID 80659872
N-(3-chloropropyl)-N-cyclobutyl-2-ethoxybenzamide
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CID 80652592
N-cyclopropyl-2-ethoxy-N-[(2-fluorophenyl)methyl]benzamide
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2-ethoxy-N-ethyl-N-pyrrolidin-3-ylbenzamide
CID 55026177
N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-ethoxybenzamide
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2-ethoxy-N-(oxan-4-yl)-N-(2-thiophen-2-ylethyl)benzamide
CID 90610971
N-(2-aminoethyl)-N-cyclopropyl-2-(4-fluorophenyl)benzamide
CID 68726599
2-[cyclopropyl-[2-[(2-ethoxybenzoyl)amino]acetyl]amino]acetic acid
CID 120517637
N-(2-aminoethyl)-N-cyclobutyl-3-hydroxy-2-methylbenzamide
CID 102874159
2-[cyclohexyl(ethyl)amino]-1-(2-ethoxyphenyl)ethanone
CID 43794243
[2-(aminomethyl)cyclohexyl]-(2-ethoxyphenyl)methanone
CID 116584488

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide?
The IUPAC name of N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide (CID 61349951) is N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide.
What is the SMILES notation for N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide?
The canonical SMILES for N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide is CCOc1ccccc1C(=O)N(CCN)C1CC1.
What is the InChIKey of N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide?
The InChIKey is XMJVFCDTXRNXQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-2-18-13-6-4-3-5-12(13)14(17)16(10-9-15)11-7-8-11/h3-6,11H,2,7-10,15H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide?
N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide has a molecular weight of 248.33 g/mol, XLogP of 1.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-cyclopropyl-2-ethoxybenzamide is sourced from PubChem (CID 61349951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).