N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide

C17H21N3O2 — CID 71987070

IUPACN-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(CC(=O)NC(c2ccccn2)C2CCCC2)no1
InChIInChI=1S/C17H21N3O2/c1-12-10-14(20-22-12)11-16(21)19-17(13-6-2-3-7-13)15-8-4-5-9-18-15/h4-5,8-10,13,17H,2-3,6-7,11H2,1H3,(H,19,21)
InChIKeyVCUHQBSACJONEH-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.97
Rot. Bonds5

About N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide

N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide (PubChem CID 71987070) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
PubChem CID71987070
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC NameN-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(CC(=O)NC(c2ccccn2)C2CCCC2)no1
InChIInChI=1S/C17H21N3O2/c1-12-10-14(20-22-12)11-16(21)19-17(13-6-2-3-7-13)15-8-4-5-9-18-15/h4-5,8-10,13,17H,2-3,6-7,11H2,1H3,(H,19,21)
InChIKeyVCUHQBSACJONEH-UHFFFAOYSA-N
XLogP2.97
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide (CID 71987070) is N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide is Cc1cc(CC(=O)NC(c2ccccn2)C2CCCC2)no1.
What is the InChIKey of N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is VCUHQBSACJONEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-12-10-14(20-22-12)11-16(21)19-17(13-6-2-3-7-13)15-8-4-5-9-18-15/h4-5,8-10,13,17H,2-3,6-7,11H2,1H3,(H,19,21).
What are the key properties of N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide?
N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 299.37 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopentyl(pyridin-2-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 71987070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).