N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide

C22H22N2O2 — CID 24765103

IUPACN-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide
SMILESC[C@@H](NC(=O)Cc1ccc(-c2ccccc2)cc1)c1ccc(CO)cn1
InChIInChI=1S/C22H22N2O2/c1-16(21-12-9-18(15-25)14-23-21)24-22(26)13-17-7-10-20(11-8-17)19-5-3-2-4-6-19/h2-12,14,16,25H,13,15H2,1H3,(H,24,26)/t16-/m1/s1
InChIKeyCHKHFJHGXVOPIJ-MRXNPFEDSA-N
MW346.43 g/mol
LogP3.66
Rot. Bonds6

About N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide

N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide (PubChem CID 24765103) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide.

Molecular Properties

Compound NameN-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide
PubChem CID24765103
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC NameN-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide
SMILESC[C@@H](NC(=O)Cc1ccc(-c2ccccc2)cc1)c1ccc(CO)cn1
InChIInChI=1S/C22H22N2O2/c1-16(21-12-9-18(15-25)14-23-21)24-22(26)13-17-7-10-20(11-8-17)19-5-3-2-4-6-19/h2-12,14,16,25H,13,15H2,1H3,(H,24,26)/t16-/m1/s1
InChIKeyCHKHFJHGXVOPIJ-MRXNPFEDSA-N
XLogP3.66
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide?
The IUPAC name of N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide (CID 24765103) is N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide.
What is the SMILES notation for N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide?
The canonical SMILES for N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide is C[C@@H](NC(=O)Cc1ccc(-c2ccccc2)cc1)c1ccc(CO)cn1.
What is the InChIKey of N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide?
The InChIKey is CHKHFJHGXVOPIJ-MRXNPFEDSA-N. The full InChI is InChI=1S/C22H22N2O2/c1-16(21-12-9-18(15-25)14-23-21)24-22(26)13-17-7-10-20(11-8-17)19-5-3-2-4-6-19/h2-12,14,16,25H,13,15H2,1H3,(H,24,26)/t16-/m1/s1.
What are the key properties of N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide?
N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide has a molecular weight of 346.43 g/mol, XLogP of 3.66, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-[5-(hydroxymethyl)-2-pyridinyl]ethyl]-2-(4-phenylphenyl)acetamide is sourced from PubChem (CID 24765103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).