N-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride

C14H23ClN2O3 — CID 120655264

IUPACN-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride
SMILESCCN[C@H](C)CNC(=O)c1ccc(OC)c(OC)c1.Cl
InChIInChI=1S/C14H22N2O3.ClH/c1-5-15-10(2)9-16-14(17)11-6-7-12(18-3)13(8-11)19-4;/h6-8,10,15H,5,9H2,1-4H3,(H,16,17);1H/t10-;/m1./s1
InChIKeyAQMPAIBMCNWHIR-HNCPQSOCSA-N
MW302.80 g/mol
LogP1.85
Rot. Bonds7

About N-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride

N-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride (PubChem CID 120655264) has the molecular formula C14H23ClN2O3 and a molecular weight of 302.80 g/mol. Its IUPAC name is N-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride.

Molecular Properties

Compound NameN-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride
PubChem CID120655264
Molecular FormulaC14H23ClN2O3
Molecular Weight302.80 g/mol
Exact Mass302.14
IUPAC NameN-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride
SMILESCCN[C@H](C)CNC(=O)c1ccc(OC)c(OC)c1.Cl
InChIInChI=1S/C14H22N2O3.ClH/c1-5-15-10(2)9-16-14(17)11-6-7-12(18-3)13(8-11)19-4;/h6-8,10,15H,5,9H2,1-4H3,(H,16,17);1H/t10-;/m1./s1
InChIKeyAQMPAIBMCNWHIR-HNCPQSOCSA-N
XLogP1.85
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.80
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(difluoromethoxy)-N-[(2R)-2-(ethylamino)propyl]-3-methoxybenzamide
CID 120654617
N-[(2R)-2-(ethylamino)propyl]-3-methoxy-4-[2-oxo-2-(propan-2-ylamino)ethoxy]benzamide
CID 120654487
3-(dimethylsulfamoyl)-N-[(2R)-2-(ethylamino)propyl]-4-methoxybenzamide
CID 120650659
3-methoxy-N-[2-(methylamino)propyl]-4-(2-methylpropoxy)benzamide;hydrochloride
CID 120829798
N-[(2R)-2-(ethylamino)propyl]-2-iodo-4,5-dimethoxybenzamide;hydrochloride
CID 120653648
4-ethoxy-N-(2-hydroxypropyl)-3-methoxybenzamide
CID 43391198
N-(2-bromo-3-ethylpentyl)-3,4-dimethoxybenzamide
CID 106288438
3-methoxy-N-[2-(methylamino)propyl]-4-[2-oxo-2-(propan-2-ylamino)ethoxy]benzamide
CID 120832066
N-[(2R)-2-(ethylamino)propyl]-2-methoxybenzamide
CID 120650635
3-[(3-ethoxy-4-methoxybenzoyl)amino]-2-methylpropanoic acid
CID 62675508
N-[2-(ethylamino)ethyl]-3,4-dimethoxybenzamide
CID 55100526
3-chloro-N-[(2R)-2-(ethylamino)propyl]-5-methoxy-4-(2-methylpropoxy)benzamide
CID 120653783

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride?
The IUPAC name of N-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride (CID 120655264) is N-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride.
What is the SMILES notation for N-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride?
The canonical SMILES for N-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride is CCN[C@H](C)CNC(=O)c1ccc(OC)c(OC)c1.Cl.
What is the InChIKey of N-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride?
The InChIKey is AQMPAIBMCNWHIR-HNCPQSOCSA-N. The full InChI is InChI=1S/C14H22N2O3.ClH/c1-5-15-10(2)9-16-14(17)11-6-7-12(18-3)13(8-11)19-4;/h6-8,10,15H,5,9H2,1-4H3,(H,16,17);1H/t10-;/m1./s1.
What are the key properties of N-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride?
N-[(2R)-2-(ethylamino)propyl]-3,4-dimethoxybenzamide;hydrochloride has a molecular weight of 302.80 g/mol, XLogP of 1.85, 7 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]-3,4-dimethoxybenzamide;hydrochloride is sourced from PubChem (CID 120655264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).