4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide

C19H21N5O3 — CID 126803316

IUPAC4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide
SMILESNC(=O)c1cc(OC2CCN(Cc3ccc(-c4ccn[nH]4)o3)CC2)ccn1
InChIInChI=1S/C19H21N5O3/c20-19(25)17-11-14(3-7-21-17)26-13-5-9-24(10-6-13)12-15-1-2-18(27-15)16-4-8-22-23-16/h1-4,7-8,11,13H,5-6,9-10,12H2,(H2,20,25)(H,22,23)
InChIKeyDUDFKUUYQWGCRZ-UHFFFAOYSA-N
MW367.41 g/mol
LogP2.21
Rot. Bonds6

About 4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide

4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide (PubChem CID 126803316) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is 4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide.

Molecular Properties

Compound Name4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide
PubChem CID126803316
Molecular FormulaC19H21N5O3
Molecular Weight367.41 g/mol
Exact Mass367.16
IUPAC Name4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide
SMILESNC(=O)c1cc(OC2CCN(Cc3ccc(-c4ccn[nH]4)o3)CC2)ccn1
InChIInChI=1S/C19H21N5O3/c20-19(25)17-11-14(3-7-21-17)26-13-5-9-24(10-6-13)12-15-1-2-18(27-15)16-4-8-22-23-16/h1-4,7-8,11,13H,5-6,9-10,12H2,(H2,20,25)(H,22,23)
InChIKeyDUDFKUUYQWGCRZ-UHFFFAOYSA-N
XLogP2.21
TPSA110.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide?
The IUPAC name of 4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide (CID 126803316) is 4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide.
What is the SMILES notation for 4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide?
The canonical SMILES for 4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide is NC(=O)c1cc(OC2CCN(Cc3ccc(-c4ccn[nH]4)o3)CC2)ccn1.
What is the InChIKey of 4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide?
The InChIKey is DUDFKUUYQWGCRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c20-19(25)17-11-14(3-7-21-17)26-13-5-9-24(10-6-13)12-15-1-2-18(27-15)16-4-8-22-23-16/h1-4,7-8,11,13H,5-6,9-10,12H2,(H2,20,25)(H,22,23).
What are the key properties of 4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide?
4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide has a molecular weight of 367.41 g/mol, XLogP of 2.21, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[[5-(1H-pyrazol-5-yl)furan-2-yl]methyl]piperidin-4-yl]oxypyridine-2-carboxamide is sourced from PubChem (CID 126803316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).