N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide

C19H25N5O2 — CID 126813661

IUPACN-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide
SMILESCCN(CC1CCN(c2ccccn2)CC1)C(=O)c1cc2n(n1)CCO2
InChIInChI=1S/C19H25N5O2/c1-2-22(19(25)16-13-18-24(21-16)11-12-26-18)14-15-6-9-23(10-7-15)17-5-3-4-8-20-17/h3-5,8,13,15H,2,6-7,9-12,14H2,1H3
InChIKeyHVJOEPVHSMNSPJ-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.05
Rot. Bonds5

About N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide

N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide (PubChem CID 126813661) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide
PubChem CID126813661
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC NameN-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide
SMILESCCN(CC1CCN(c2ccccn2)CC1)C(=O)c1cc2n(n1)CCO2
InChIInChI=1S/C19H25N5O2/c1-2-22(19(25)16-13-18-24(21-16)11-12-26-18)14-15-6-9-23(10-7-15)17-5-3-4-8-20-17/h3-5,8,13,15H,2,6-7,9-12,14H2,1H3
InChIKeyHVJOEPVHSMNSPJ-UHFFFAOYSA-N
XLogP2.05
TPSA63.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide?
The IUPAC name of N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide (CID 126813661) is N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide.
What is the SMILES notation for N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide?
The canonical SMILES for N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide is CCN(CC1CCN(c2ccccn2)CC1)C(=O)c1cc2n(n1)CCO2.
What is the InChIKey of N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide?
The InChIKey is HVJOEPVHSMNSPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-2-22(19(25)16-13-18-24(21-16)11-12-26-18)14-15-6-9-23(10-7-15)17-5-3-4-8-20-17/h3-5,8,13,15H,2,6-7,9-12,14H2,1H3.
What are the key properties of N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide?
N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 2.05, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide is sourced from PubChem (CID 126813661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).