2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide

C19H21ClN2O2 — CID 120655275

IUPAC2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide
SMILESCCN[C@H](C)CNC(=O)c1ccccc1C(=O)c1ccc(Cl)cc1
InChIInChI=1S/C19H21ClN2O2/c1-3-21-13(2)12-22-19(24)17-7-5-4-6-16(17)18(23)14-8-10-15(20)11-9-14/h4-11,13,21H,3,12H2,1-2H3,(H,22,24)/t13-/m1/s1
InChIKeyYITZEMZCBXEABN-CYBMUJFWSA-N
MW344.84 g/mol
LogP3.30
Rot. Bonds7

About 2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide

2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide (PubChem CID 120655275) has the molecular formula C19H21ClN2O2 and a molecular weight of 344.84 g/mol. Its IUPAC name is 2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide.

Molecular Properties

Compound Name2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide
PubChem CID120655275
Molecular FormulaC19H21ClN2O2
Molecular Weight344.84 g/mol
Exact Mass344.13
IUPAC Name2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide
SMILESCCN[C@H](C)CNC(=O)c1ccccc1C(=O)c1ccc(Cl)cc1
InChIInChI=1S/C19H21ClN2O2/c1-3-21-13(2)12-22-19(24)17-7-5-4-6-16(17)18(23)14-8-10-15(20)11-9-14/h4-11,13,21H,3,12H2,1-2H3,(H,22,24)/t13-/m1/s1
InChIKeyYITZEMZCBXEABN-CYBMUJFWSA-N
XLogP3.30
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.84
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-benzoyl-N-[(2R)-2-(ethylamino)propyl]benzamide
CID 120654591
2-(4-chlorobenzoyl)-N-(2-methylpropyl)benzamide
CID 11841449
2-acetyl-N-[(2R)-2-(ethylamino)propyl]benzamide
CID 120652333
5-chloro-N-[(2R)-2-(ethylamino)propyl]-2-ethylsulfanylbenzamide
CID 120652149
5-chloro-N-[(2R)-2-(ethylamino)propyl]-2-fluorobenzamide;hydrochloride
CID 120651308
N-[(2R)-2-(ethylamino)propyl]-2-methylsulfanylbenzamide
CID 120650563
2-benzyl-N-[(2R)-2-(ethylamino)propyl]benzamide
CID 120650587
2-bromo-5-chloro-N-[(2R)-2-(ethylamino)propyl]benzamide
CID 120654149
N-[(2R)-2-(ethylamino)propyl]-2-methoxybenzamide
CID 120650635
N-[(2R)-2-(ethylamino)propyl]-2-propan-2-ylsulfonylbenzamide
CID 120653669
3,5-dichloro-N-[(2R)-2-(ethylamino)propyl]benzamide;hydrochloride
CID 120654646
N-[(2R)-2-(ethylamino)propyl]-2,5-difluorobenzamide
CID 120651737

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide?
The IUPAC name of 2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide (CID 120655275) is 2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide.
What is the SMILES notation for 2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide?
The canonical SMILES for 2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide is CCN[C@H](C)CNC(=O)c1ccccc1C(=O)c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide?
The InChIKey is YITZEMZCBXEABN-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H21ClN2O2/c1-3-21-13(2)12-22-19(24)17-7-5-4-6-16(17)18(23)14-8-10-15(20)11-9-14/h4-11,13,21H,3,12H2,1-2H3,(H,22,24)/t13-/m1/s1.
What are the key properties of 2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide?
2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide has a molecular weight of 344.84 g/mol, XLogP of 3.30, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorobenzoyl)-N-[(2R)-2-(ethylamino)propyl]benzamide is sourced from PubChem (CID 120655275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).