N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride

C20H27ClN2O3 — CID 120654572

IUPACN-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride
SMILESCCN[C@H](C)CNC(=O)COc1ccc(OCc2ccccc2)cc1.Cl
InChIInChI=1S/C20H26N2O3.ClH/c1-3-21-16(2)13-22-20(23)15-25-19-11-9-18(10-12-19)24-14-17-7-5-4-6-8-17;/h4-12,16,21H,3,13-15H2,1-2H3,(H,22,23);1H/t16-;/m1./s1
InChIKeyAUJBGBWHFHHPGT-PKLMIRHRSA-N
MW378.90 g/mol
LogP3.18
Rot. Bonds10

About N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride

N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride (PubChem CID 120654572) has the molecular formula C20H27ClN2O3 and a molecular weight of 378.90 g/mol. Its IUPAC name is N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride.

Molecular Properties

Compound NameN-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride
PubChem CID120654572
Molecular FormulaC20H27ClN2O3
Molecular Weight378.90 g/mol
Exact Mass378.17
IUPAC NameN-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride
SMILESCCN[C@H](C)CNC(=O)COc1ccc(OCc2ccccc2)cc1.Cl
InChIInChI=1S/C20H26N2O3.ClH/c1-3-21-16(2)13-22-20(23)15-25-19-11-9-18(10-12-19)24-14-17-7-5-4-6-8-17;/h4-12,16,21H,3,13-15H2,1-2H3,(H,22,23);1H/t16-;/m1./s1
InChIKeyAUJBGBWHFHHPGT-PKLMIRHRSA-N
XLogP3.18
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.90
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chlorophenoxy)-N-[(2R)-2-(ethylamino)propyl]acetamide;hydrochloride
CID 120653266
N-ethyl-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]acetamide
CID 9224487
N-[(2R)-2-(ethylamino)propyl]-2-(2-ethylphenoxy)acetamide;hydrochloride
CID 120653148
N-[(2S)-2-(dimethylamino)-2-phenylethyl]-2-(4-phenylmethoxyphenoxy)acetamide
CID 2111801
N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide
CID 120650597
N-[(2R)-2-(ethylamino)propyl]-4-phenoxybutanamide;hydrochloride
CID 120651118
N-(2-morpholin-4-ylpropyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 55612253
N-[(2R)-2-(ethylamino)propyl]-2-(2-nitrophenoxy)acetamide;hydrochloride
CID 120653870
2-(3-chloro-4-fluorophenoxy)-N-[(2R)-2-(ethylamino)propyl]acetamide
CID 120653969
2-[4-[2-(ethylamino)propyl]phenoxy]-N-propylacetamide
CID 115495042
N-(2-ethylbutyl)-2-phenoxyacetamide
CID 115612512
2-[4-[3-(ethylamino)butyl]phenoxy]-N-propylacetamide
CID 43279784

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride?
The IUPAC name of N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride (CID 120654572) is N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride.
What is the SMILES notation for N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride?
The canonical SMILES for N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride is CCN[C@H](C)CNC(=O)COc1ccc(OCc2ccccc2)cc1.Cl.
What is the InChIKey of N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride?
The InChIKey is AUJBGBWHFHHPGT-PKLMIRHRSA-N. The full InChI is InChI=1S/C20H26N2O3.ClH/c1-3-21-16(2)13-22-20(23)15-25-19-11-9-18(10-12-19)24-14-17-7-5-4-6-8-17;/h4-12,16,21H,3,13-15H2,1-2H3,(H,22,23);1H/t16-;/m1./s1.
What are the key properties of N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride?
N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride has a molecular weight of 378.90 g/mol, XLogP of 3.18, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(ethylamino)propyl]-2-(4-phenylmethoxyphenoxy)acetamide;hydrochloride is sourced from PubChem (CID 120654572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).