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

C14H23ClN2O — CID 120653288

IUPACN-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride
SMILESCCN[C@H](C)CNC(=O)c1ccc(C)cc1C.Cl
InChIInChI=1S/C14H22N2O.ClH/c1-5-15-12(4)9-16-14(17)13-7-6-10(2)8-11(13)3;/h6-8,12,15H,5,9H2,1-4H3,(H,16,17);1H/t12-;/m1./s1
InChIKeyFEBXZANOALMNTF-UTONKHPSSA-N
MW270.80 g/mol
LogP2.45
Rot. Bonds5

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

N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride (PubChem CID 120653288) has the molecular formula C14H23ClN2O and a molecular weight of 270.80 g/mol. Its IUPAC name is N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride.

Molecular Properties

Compound NameN-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride
PubChem CID120653288
Molecular FormulaC14H23ClN2O
Molecular Weight270.80 g/mol
Exact Mass270.15
IUPAC NameN-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride
SMILESCCN[C@H](C)CNC(=O)c1ccc(C)cc1C.Cl
InChIInChI=1S/C14H22N2O.ClH/c1-5-15-12(4)9-16-14(17)13-7-6-10(2)8-11(13)3;/h6-8,12,15H,5,9H2,1-4H3,(H,16,17);1H/t12-;/m1./s1
InChIKeyFEBXZANOALMNTF-UTONKHPSSA-N
XLogP2.45
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.80
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide
CID 120653289
N-[(2R)-2-(ethylamino)propyl]-2-fluoro-5-methylbenzamide
CID 120654085
N-[(2R)-2-(ethylamino)propyl]-4-methylthiophene-3-carboxamide;hydrochloride
CID 120651296
2,4-dimethyl-N-[(2S)-2-phenylpropyl]benzamide
CID 26778990
5-chloro-N-[(2R)-2-(ethylamino)propyl]-2-fluorobenzamide;hydrochloride
CID 120651308
4-bromo-N-[(2R)-2-(ethylamino)propyl]-2-fluorobenzamide
CID 120650065
N-[2-(2-hydroxyethyl)pentyl]-2,4-dimethylbenzamide
CID 103722758
2-acetyl-N-[(2R)-2-(ethylamino)propyl]benzamide
CID 120652333
1-ethyl-N-[(2R)-2-(ethylamino)propyl]-2,5-dimethylpyrrole-3-carboxamide
CID 120654873
N-[(2R)-2-(ethylamino)propyl]-2-methoxybenzamide
CID 120650635
N-[(2R)-2-(ethylamino)propyl]-2,5-difluorobenzamide
CID 120651737
2-bromo-N-[(2R)-2-(ethylamino)propyl]-5-fluorobenzamide;hydrochloride
CID 120651990

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride?
The IUPAC name of N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride (CID 120653288) is N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride.
What is the SMILES notation for N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride?
The canonical SMILES for N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride is CCN[C@H](C)CNC(=O)c1ccc(C)cc1C.Cl.
What is the InChIKey of N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride?
The InChIKey is FEBXZANOALMNTF-UTONKHPSSA-N. The full InChI is InChI=1S/C14H22N2O.ClH/c1-5-15-12(4)9-16-14(17)13-7-6-10(2)8-11(13)3;/h6-8,12,15H,5,9H2,1-4H3,(H,16,17);1H/t12-;/m1./s1.
What are the key properties of N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride?
N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride has a molecular weight of 270.80 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide;hydrochloride is sourced from PubChem (CID 120653288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).