2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide

C23H19ClN2O — CID 35130080

IUPAC2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide
SMILESO=C(NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)c1ccccc1Cl
InChIInChI=1S/C23H19ClN2O/c24-21-12-6-4-11-18(21)23(27)26-14-19(16-8-2-1-3-9-16)20-15-25-22-13-7-5-10-17(20)22/h1-13,15,19,25H,14H2,(H,26,27)/t19-/m1/s1
InChIKeyYEHGHCXFJMVDTB-LJQANCHMSA-N
MW374.87 g/mol
LogP5.38
Rot. Bonds5

About 2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide

2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide (PubChem CID 35130080) has the molecular formula C23H19ClN2O and a molecular weight of 374.87 g/mol. Its IUPAC name is 2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide
PubChem CID35130080
Molecular FormulaC23H19ClN2O
Molecular Weight374.87 g/mol
Exact Mass374.12
IUPAC Name2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide
SMILESO=C(NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)c1ccccc1Cl
InChIInChI=1S/C23H19ClN2O/c24-21-12-6-4-11-18(21)23(27)26-14-19(16-8-2-1-3-9-16)20-15-25-22-13-7-5-10-17(20)22/h1-13,15,19,25H,14H2,(H,26,27)/t19-/m1/s1
InChIKeyYEHGHCXFJMVDTB-LJQANCHMSA-N
XLogP5.38
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.87
LogP ≤ 55.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]-2-methylbenzamide
CID 35180736
2-bromo-N-[2-(1H-indol-3-yl)-2-phenylethyl]benzamide
CID 17014637
2-bromo-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide
CID 26243574
4-chloro-N-[(2S)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide
CID 8019643
N-[2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]naphthalene-1-carboxamide
CID 154810722
2,6-difluoro-N-[2-(1H-indol-3-yl)-2-phenylethyl]benzamide
CID 46553423
3-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide
CID 35130101
2,4-difluoro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide
CID 26243582
2-chloro-N-[2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide
CID 55341798
2-chloro-N-[(1S)-3-[[(2S)-2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]amino]-3-oxo-1-phenylpropyl]benzamide
CID 2410230
N-[2-(1H-indol-3-yl)-2-phenylethyl]thiophene-2-carboxamide
CID 4880396
N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-methoxybenzamide
CID 17014418

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide?
The IUPAC name of 2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide (CID 35130080) is 2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide.
What is the SMILES notation for 2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide?
The canonical SMILES for 2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide is O=C(NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide?
The InChIKey is YEHGHCXFJMVDTB-LJQANCHMSA-N. The full InChI is InChI=1S/C23H19ClN2O/c24-21-12-6-4-11-18(21)23(27)26-14-19(16-8-2-1-3-9-16)20-15-25-22-13-7-5-10-17(20)22/h1-13,15,19,25H,14H2,(H,26,27)/t19-/m1/s1.
What are the key properties of 2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide?
2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide has a molecular weight of 374.87 g/mol, XLogP of 5.38, 5 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide is sourced from PubChem (CID 35130080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).