2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide

C25H26N2O2 — CID 53319030

IUPAC2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide
SMILESC[C@@H](NC(=O)Cc1ccc(C2CC2)cc1)c1ccc(OCc2ccccc2)cn1
InChIInChI=1S/C25H26N2O2/c1-18(27-25(28)15-19-7-9-21(10-8-19)22-11-12-22)24-14-13-23(16-26-24)29-17-20-5-3-2-4-6-20/h2-10,13-14,16,18,22H,11-12,15,17H2,1H3,(H,27,28)/t18-/m1/s1
InChIKeyWEDRCRAFXXEUCP-GOSISDBHSA-N
MW386.50 g/mol
LogP4.96
Rot. Bonds8

About 2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide

2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide (PubChem CID 53319030) has the molecular formula C25H26N2O2 and a molecular weight of 386.50 g/mol. Its IUPAC name is 2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide
PubChem CID53319030
Molecular FormulaC25H26N2O2
Molecular Weight386.50 g/mol
Exact Mass386.20
IUPAC Name2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide
SMILESC[C@@H](NC(=O)Cc1ccc(C2CC2)cc1)c1ccc(OCc2ccccc2)cn1
InChIInChI=1S/C25H26N2O2/c1-18(27-25(28)15-19-7-9-21(10-8-19)22-11-12-22)24-14-13-23(16-26-24)29-17-20-5-3-2-4-6-20/h2-10,13-14,16,18,22H,11-12,15,17H2,1H3,(H,27,28)/t18-/m1/s1
InChIKeyWEDRCRAFXXEUCP-GOSISDBHSA-N
XLogP4.96
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide?
The IUPAC name of 2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide (CID 53319030) is 2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide.
What is the SMILES notation for 2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide?
The canonical SMILES for 2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide is C[C@@H](NC(=O)Cc1ccc(C2CC2)cc1)c1ccc(OCc2ccccc2)cn1.
What is the InChIKey of 2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide?
The InChIKey is WEDRCRAFXXEUCP-GOSISDBHSA-N. The full InChI is InChI=1S/C25H26N2O2/c1-18(27-25(28)15-19-7-9-21(10-8-19)22-11-12-22)24-14-13-23(16-26-24)29-17-20-5-3-2-4-6-20/h2-10,13-14,16,18,22H,11-12,15,17H2,1H3,(H,27,28)/t18-/m1/s1.
What are the key properties of 2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide?
2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide has a molecular weight of 386.50 g/mol, XLogP of 4.96, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylphenyl)-N-[(1R)-1-(5-phenylmethoxy-2-pyridinyl)ethyl]acetamide is sourced from PubChem (CID 53319030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).