(2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide

C23H24N2O2 — CID 8545508

IUPAC(2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide
SMILESCOc1cccc(NC(=O)[C@@H](C)NC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C23H24N2O2/c1-17(23(26)25-20-14-9-15-21(16-20)27-2)24-22(18-10-5-3-6-11-18)19-12-7-4-8-13-19/h3-17,22,24H,1-2H3,(H,25,26)/t17-/m1/s1
InChIKeyALUFXXRHSZEAGD-QGZVFWFLSA-N
MW360.46 g/mol
LogP4.40
Rot. Bonds7

About (2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide

(2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide (PubChem CID 8545508) has the molecular formula C23H24N2O2 and a molecular weight of 360.46 g/mol. Its IUPAC name is (2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide
PubChem CID8545508
Molecular FormulaC23H24N2O2
Molecular Weight360.46 g/mol
Exact Mass360.18
IUPAC Name(2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide
SMILESCOc1cccc(NC(=O)[C@@H](C)NC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C23H24N2O2/c1-17(23(26)25-20-14-9-15-21(16-20)27-2)24-22(18-10-5-3-6-11-18)19-12-7-4-8-13-19/h3-17,22,24H,1-2H3,(H,25,26)/t17-/m1/s1
InChIKeyALUFXXRHSZEAGD-QGZVFWFLSA-N
XLogP4.40
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide?
The IUPAC name of (2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide (CID 8545508) is (2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide.
What is the SMILES notation for (2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide?
The canonical SMILES for (2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide is COc1cccc(NC(=O)[C@@H](C)NC(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of (2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide?
The InChIKey is ALUFXXRHSZEAGD-QGZVFWFLSA-N. The full InChI is InChI=1S/C23H24N2O2/c1-17(23(26)25-20-14-9-15-21(16-20)27-2)24-22(18-10-5-3-6-11-18)19-12-7-4-8-13-19/h3-17,22,24H,1-2H3,(H,25,26)/t17-/m1/s1.
What are the key properties of (2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide?
(2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide has a molecular weight of 360.46 g/mol, XLogP of 4.40, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide is sourced from PubChem (CID 8545508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).