2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide

C16H20N4O2 — CID 91625981

IUPAC2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide
SMILESO=C(Cn1cccn1)NC1CCC(Oc2ccccn2)CC1
InChIInChI=1S/C16H20N4O2/c21-15(12-20-11-3-10-18-20)19-13-5-7-14(8-6-13)22-16-4-1-2-9-17-16/h1-4,9-11,13-14H,5-8,12H2,(H,19,21)
InChIKeyDLCBQHYGATYSDP-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.78
Rot. Bonds5

About 2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide

2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide (PubChem CID 91625981) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide.

Molecular Properties

Compound Name2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide
PubChem CID91625981
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide
SMILESO=C(Cn1cccn1)NC1CCC(Oc2ccccn2)CC1
InChIInChI=1S/C16H20N4O2/c21-15(12-20-11-3-10-18-20)19-13-5-7-14(8-6-13)22-16-4-1-2-9-17-16/h1-4,9-11,13-14H,5-8,12H2,(H,19,21)
InChIKeyDLCBQHYGATYSDP-UHFFFAOYSA-N
XLogP1.78
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide?
The IUPAC name of 2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide (CID 91625981) is 2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide.
What is the SMILES notation for 2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide?
The canonical SMILES for 2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide is O=C(Cn1cccn1)NC1CCC(Oc2ccccn2)CC1.
What is the InChIKey of 2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide?
The InChIKey is DLCBQHYGATYSDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c21-15(12-20-11-3-10-18-20)19-13-5-7-14(8-6-13)22-16-4-1-2-9-17-16/h1-4,9-11,13-14H,5-8,12H2,(H,19,21).
What are the key properties of 2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide?
2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide has a molecular weight of 300.36 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazol-1-yl-N-(4-pyridin-2-yloxycyclohexyl)acetamide is sourced from PubChem (CID 91625981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).