N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide

C14H18N4O2 — CID 71918259

IUPACN-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide
SMILESCCOc1cccc(CCNC(=O)Cc2ccn[nH]2)n1
InChIInChI=1S/C14H18N4O2/c1-2-20-14-5-3-4-11(17-14)6-8-15-13(19)10-12-7-9-16-18-12/h3-5,7,9H,2,6,8,10H2,1H3,(H,15,19)(H,16,18)
InChIKeyCWCAFMGSDSGDJP-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.10
Rot. Bonds7

About N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide

N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide (PubChem CID 71918259) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide.

Molecular Properties

Compound NameN-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide
PubChem CID71918259
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC NameN-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide
SMILESCCOc1cccc(CCNC(=O)Cc2ccn[nH]2)n1
InChIInChI=1S/C14H18N4O2/c1-2-20-14-5-3-4-11(17-14)6-8-15-13(19)10-12-7-9-16-18-12/h3-5,7,9H,2,6,8,10H2,1H3,(H,15,19)(H,16,18)
InChIKeyCWCAFMGSDSGDJP-UHFFFAOYSA-N
XLogP1.10
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide?
The IUPAC name of N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide (CID 71918259) is N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide.
What is the SMILES notation for N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide?
The canonical SMILES for N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide is CCOc1cccc(CCNC(=O)Cc2ccn[nH]2)n1.
What is the InChIKey of N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide?
The InChIKey is CWCAFMGSDSGDJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-2-20-14-5-3-4-11(17-14)6-8-15-13(19)10-12-7-9-16-18-12/h3-5,7,9H,2,6,8,10H2,1H3,(H,15,19)(H,16,18).
What are the key properties of N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide?
N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide has a molecular weight of 274.32 g/mol, XLogP of 1.10, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-ethoxy-2-pyridinyl)ethyl]-2-(1H-pyrazol-5-yl)acetamide is sourced from PubChem (CID 71918259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).