(2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride

C14H22ClN3O3 — CID 119267268

IUPAC(2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride
SMILESCCN(CC(=O)Nc1ccccc1OC)C(=O)[C@@H](C)N.Cl
InChIInChI=1S/C14H21N3O3.ClH/c1-4-17(14(19)10(2)15)9-13(18)16-11-7-5-6-8-12(11)20-3;/h5-8,10H,4,9,15H2,1-3H3,(H,16,18);1H/t10-;/m1./s1
InChIKeyBZYQRMRTCASEQG-HNCPQSOCSA-N
MW315.80 g/mol
LogP1.25
Rot. Bonds6

About (2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride

(2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride (PubChem CID 119267268) has the molecular formula C14H22ClN3O3 and a molecular weight of 315.80 g/mol. Its IUPAC name is (2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride
PubChem CID119267268
Molecular FormulaC14H22ClN3O3
Molecular Weight315.80 g/mol
Exact Mass315.13
IUPAC Name(2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride
SMILESCCN(CC(=O)Nc1ccccc1OC)C(=O)[C@@H](C)N.Cl
InChIInChI=1S/C14H21N3O3.ClH/c1-4-17(14(19)10(2)15)9-13(18)16-11-7-5-6-8-12(11)20-3;/h5-8,10H,4,9,15H2,1-3H3,(H,16,18);1H/t10-;/m1./s1
InChIKeyBZYQRMRTCASEQG-HNCPQSOCSA-N
XLogP1.25
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.80
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120787699
2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylpentanamide;hydrochloride
CID 119267711
N',N'-diethyl-N-(2-methoxyphenyl)oxamide
CID 47335830
2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylacetamide
CID 119267704
3-[ethyl-[2-(2-methoxyanilino)-2-oxoethyl]amino]butanoic acid
CID 62827296
2-(N-ethylanilino)-N-(2-methoxyphenyl)acetamide
CID 17052689
N-ethyl-3-methoxy-N-[2-(2-methoxyanilino)-2-oxoethyl]-4-methylbenzamide
CID 46563290
2-[(3-amino-4-methylpentyl)-methylamino]-N-(2-methoxyphenyl)acetamide
CID 81496851
N-ethyl-3-(4-ethylphenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide
CID 51184271
9-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120983709
N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119291082
2-[2-cyanopropyl(ethyl)amino]-N-(2-methoxyphenyl)acetamide
CID 60674387

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride?
The IUPAC name of (2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride (CID 119267268) is (2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride.
What is the SMILES notation for (2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride?
The canonical SMILES for (2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride is CCN(CC(=O)Nc1ccccc1OC)C(=O)[C@@H](C)N.Cl.
What is the InChIKey of (2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride?
The InChIKey is BZYQRMRTCASEQG-HNCPQSOCSA-N. The full InChI is InChI=1S/C14H21N3O3.ClH/c1-4-17(14(19)10(2)15)9-13(18)16-11-7-5-6-8-12(11)20-3;/h5-8,10H,4,9,15H2,1-3H3,(H,16,18);1H/t10-;/m1./s1.
What are the key properties of (2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride?
(2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride has a molecular weight of 315.80 g/mol, XLogP of 1.25, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride is sourced from PubChem (CID 119267268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).