(2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide

C20H23N3O — CID 40938355

IUPAC(2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide
SMILESCN(C)C(=O)[C@H](NCCc1c[nH]c2ccccc12)c1ccccc1
InChIInChI=1S/C20H23N3O/c1-23(2)20(24)19(15-8-4-3-5-9-15)21-13-12-16-14-22-18-11-7-6-10-17(16)18/h3-11,14,19,21-22H,12-13H2,1-2H3/t19-/m1/s1
InChIKeyJZGWWMMDCDIQEF-LJQANCHMSA-N
MW321.42 g/mol
LogP3.13
Rot. Bonds6

About (2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide

(2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide (PubChem CID 40938355) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is (2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide
PubChem CID40938355
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC Name(2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide
SMILESCN(C)C(=O)[C@H](NCCc1c[nH]c2ccccc12)c1ccccc1
InChIInChI=1S/C20H23N3O/c1-23(2)20(24)19(15-8-4-3-5-9-15)21-13-12-16-14-22-18-11-7-6-10-17(16)18/h3-11,14,19,21-22H,12-13H2,1-2H3/t19-/m1/s1
InChIKeyJZGWWMMDCDIQEF-LJQANCHMSA-N
XLogP3.13
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzhydryl-2-(1H-indol-3-yl)ethanamine
CID 101231581
(2S)-N-(2-ethoxyphenyl)-2-[2-(1H-indol-3-yl)ethylamino]-2-phenylacetamide
CID 7928745
(Z)-but-2-enedioic acid;N-[2-(1H-indol-3-yl)ethyl]propan-2-amine
CID 5380391
1-[2-(1H-indol-3-yl)ethylamino]propan-2-one
CID 91330877
N-[2-(1H-indol-3-yl)ethyl]-3-methylbutan-2-amine
CID 43202427
[(2S)-1-(dimethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]azanium chloride
CID 10516015
4-[2-(1H-indol-3-yl)ethylamino]-2,3-dimethyl-4-oxobutanoic acid
CID 103496413
carbamic acid;N-[2-(1H-indol-3-yl)ethyl]hydroxylamine
CID 158434815
3-(1H-indol-3-yl)-2-methoxy-N,N-dimethylpropanamide
CID 163055572
3-(1H-indol-3-yl)-N-(1-phenylethyl)propanamide
CID 582677
(2R)-2-[2-(2-chloro-4-methylphenyl)ethylamino]-1-(1H-indol-3-yl)-2-phenylethanone
CID 158771521
2-(3,3-dimethylbutylamino)-4-(1H-indol-3-yl)butanoic acid
CID 174620908

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide?
The IUPAC name of (2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide (CID 40938355) is (2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide.
What is the SMILES notation for (2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide?
The canonical SMILES for (2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide is CN(C)C(=O)[C@H](NCCc1c[nH]c2ccccc12)c1ccccc1.
What is the InChIKey of (2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide?
The InChIKey is JZGWWMMDCDIQEF-LJQANCHMSA-N. The full InChI is InChI=1S/C20H23N3O/c1-23(2)20(24)19(15-8-4-3-5-9-15)21-13-12-16-14-22-18-11-7-6-10-17(16)18/h3-11,14,19,21-22H,12-13H2,1-2H3/t19-/m1/s1.
What are the key properties of (2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide?
(2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide has a molecular weight of 321.42 g/mol, XLogP of 3.13, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[2-(1H-indol-3-yl)ethylamino]-N,N-dimethyl-2-phenylacetamide is sourced from PubChem (CID 40938355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).