N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide

C19H23ClN2O2 — CID 110278628

IUPACN-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NC(CCN(C)C)c1ccc(Cl)cc1
InChIInChI=1S/C19H23ClN2O2/c1-22(2)13-12-17(14-8-10-15(20)11-9-14)21-19(23)16-6-4-5-7-18(16)24-3/h4-11,17H,12-13H2,1-3H3,(H,21,23)
InChIKeyMUZVDUUDWHSIID-UHFFFAOYSA-N
MW346.86 g/mol
LogP3.77
Rot. Bonds7

About N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide

N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide (PubChem CID 110278628) has the molecular formula C19H23ClN2O2 and a molecular weight of 346.86 g/mol. Its IUPAC name is N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide
PubChem CID110278628
Molecular FormulaC19H23ClN2O2
Molecular Weight346.86 g/mol
Exact Mass346.14
IUPAC NameN-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NC(CCN(C)C)c1ccc(Cl)cc1
InChIInChI=1S/C19H23ClN2O2/c1-22(2)13-12-17(14-8-10-15(20)11-9-14)21-19(23)16-6-4-5-7-18(16)24-3/h4-11,17H,12-13H2,1-3H3,(H,21,23)
InChIKeyMUZVDUUDWHSIID-UHFFFAOYSA-N
XLogP3.77
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.86
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (3S)-3-(4-chlorophenyl)-3-[(2-methoxybenzoyl)amino]propanoate
CID 40813309
N-(2-chloro-1-phenylethyl)-2-methoxybenzamide
CID 114300240
N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-(4-methoxyphenyl)acetamide
CID 15983443
N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-phenylbenzamide
CID 24953415
N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide
CID 39370043
N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]pyridine-4-carboxamide
CID 110278637
2-(4-chlorophenyl)-N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]acetamide
CID 110278648
5-chloro-N-(2-hydroxy-1-phenylethyl)-2-methoxybenzamide
CID 63184777
N-[2-[[(4-chlorophenyl)-phenylmethyl]amino]-2-oxoethyl]-2-methoxybenzamide
CID 112772541
N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-5-[(3-methoxyphenoxy)methyl]furan-2-carboxamide
CID 110278361
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 3-acetamido-3-(4-chlorophenyl)propanoate
CID 55380231
N-[(1S)-1-(4-chlorophenyl)-3-(dimethylamino)propyl]-3-naphthalen-2-ylbenzamide
CID 24953762

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide?
The IUPAC name of N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide (CID 110278628) is N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide.
What is the SMILES notation for N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide?
The canonical SMILES for N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide is COc1ccccc1C(=O)NC(CCN(C)C)c1ccc(Cl)cc1.
What is the InChIKey of N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide?
The InChIKey is MUZVDUUDWHSIID-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O2/c1-22(2)13-12-17(14-8-10-15(20)11-9-14)21-19(23)16-6-4-5-7-18(16)24-3/h4-11,17H,12-13H2,1-3H3,(H,21,23).
What are the key properties of N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide?
N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide has a molecular weight of 346.86 g/mol, XLogP of 3.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-chlorophenyl)-3-(dimethylamino)propyl]-2-methoxybenzamide is sourced from PubChem (CID 110278628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).