N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide

C21H25N5O2 — CID 53187633

IUPACN-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide
SMILESO=C(Cc1cccnc1)Nc1ccc(N2CCN(C3CCCCC3)C2=O)nc1
InChIInChI=1S/C21H25N5O2/c27-20(13-16-5-4-10-22-14-16)24-17-8-9-19(23-15-17)26-12-11-25(21(26)28)18-6-2-1-3-7-18/h4-5,8-10,14-15,18H,1-3,6-7,11-13H2,(H,24,27)
InChIKeyHNERPALIIKSXMA-UHFFFAOYSA-N
MW379.46 g/mol
LogP3.23
Rot. Bonds5

About N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide

N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide (PubChem CID 53187633) has the molecular formula C21H25N5O2 and a molecular weight of 379.46 g/mol. Its IUPAC name is N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide
PubChem CID53187633
Molecular FormulaC21H25N5O2
Molecular Weight379.46 g/mol
Exact Mass379.20
IUPAC NameN-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide
SMILESO=C(Cc1cccnc1)Nc1ccc(N2CCN(C3CCCCC3)C2=O)nc1
InChIInChI=1S/C21H25N5O2/c27-20(13-16-5-4-10-22-14-16)24-17-8-9-19(23-15-17)26-12-11-25(21(26)28)18-6-2-1-3-7-18/h4-5,8-10,14-15,18H,1-3,6-7,11-13H2,(H,24,27)
InChIKeyHNERPALIIKSXMA-UHFFFAOYSA-N
XLogP3.23
TPSA78.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide?
The IUPAC name of N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide (CID 53187633) is N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide?
The canonical SMILES for N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide is O=C(Cc1cccnc1)Nc1ccc(N2CCN(C3CCCCC3)C2=O)nc1.
What is the InChIKey of N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide?
The InChIKey is HNERPALIIKSXMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O2/c27-20(13-16-5-4-10-22-14-16)24-17-8-9-19(23-15-17)26-12-11-25(21(26)28)18-6-2-1-3-7-18/h4-5,8-10,14-15,18H,1-3,6-7,11-13H2,(H,24,27).
What are the key properties of N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide?
N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide has a molecular weight of 379.46 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 53187633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).