N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide

C19H20ClN3O — CID 56532124

IUPACN-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide
SMILESCN(C)c1ccc(Cl)cc1NC(=O)CCn1ccc2ccccc21
InChIInChI=1S/C19H20ClN3O/c1-22(2)18-8-7-15(20)13-16(18)21-19(24)10-12-23-11-9-14-5-3-4-6-17(14)23/h3-9,11,13H,10,12H2,1-2H3,(H,21,24)
InChIKeyNLXGUMOOGVRXCG-UHFFFAOYSA-N
MW341.84 g/mol
LogP4.39
Rot. Bonds5

About N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide

N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide (PubChem CID 56532124) has the molecular formula C19H20ClN3O and a molecular weight of 341.84 g/mol. Its IUPAC name is N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide.

Molecular Properties

Compound NameN-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide
PubChem CID56532124
Molecular FormulaC19H20ClN3O
Molecular Weight341.84 g/mol
Exact Mass341.13
IUPAC NameN-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide
SMILESCN(C)c1ccc(Cl)cc1NC(=O)CCn1ccc2ccccc21
InChIInChI=1S/C19H20ClN3O/c1-22(2)18-8-7-15(20)13-16(18)21-19(24)10-12-23-11-9-14-5-3-4-6-17(14)23/h3-9,11,13H,10,12H2,1-2H3,(H,21,24)
InChIKeyNLXGUMOOGVRXCG-UHFFFAOYSA-N
XLogP4.39
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.84
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-N-ethyl-3-indol-1-ylpropanamide
CID 18112996
N-(2,3-dichlorophenyl)-3-indol-1-ylpropanamide
CID 84554858
N-(2,4-difluorophenyl)-3-indol-1-ylpropanamide
CID 9209396
N-[5-chloro-2-(dimethylamino)phenyl]-4-(1,3-dioxoisoindol-2-yl)butanamide
CID 78778183
4-amino-N-[5-chloro-2-(dimethylamino)phenyl]butanamide
CID 43710281
N-[5-chloro-2-(dimethylamino)phenyl]-2-(N-methylanilino)acetamide
CID 55353426
2-chloro-N-[5-chloro-2-(dimethylamino)phenyl]acetamide
CID 3710309
N-[5-chloro-2-(dimethylamino)phenyl]-4-hydroxypentanamide
CID 79204123
N-[5-chloro-2-(dimethylamino)phenyl]-2-(1-ethylbenzimidazol-2-yl)sulfanylacetamide
CID 55305598
7-amino-N-[5-chloro-2-(dimethylamino)phenyl]heptanamide;dihydrochloride
CID 119858077
N-(3-chlorophenyl)sulfonyl-3-indol-1-ylpropanamide
CID 86997837
N-[(5-chloro-2-methoxyphenyl)methyl]-3-indol-1-yl-N-methylpropanamide
CID 40686377

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide?
The IUPAC name of N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide (CID 56532124) is N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide.
What is the SMILES notation for N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide?
The canonical SMILES for N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide is CN(C)c1ccc(Cl)cc1NC(=O)CCn1ccc2ccccc21.
What is the InChIKey of N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide?
The InChIKey is NLXGUMOOGVRXCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O/c1-22(2)18-8-7-15(20)13-16(18)21-19(24)10-12-23-11-9-14-5-3-4-6-17(14)23/h3-9,11,13H,10,12H2,1-2H3,(H,21,24).
What are the key properties of N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide?
N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide has a molecular weight of 341.84 g/mol, XLogP of 4.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-chloro-2-(dimethylamino)phenyl]-3-indol-1-ylpropanamide is sourced from PubChem (CID 56532124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).