1-ethyl-2-pyrazol-1-yl-2H-pyridine

C10H13N3 — CID 18174949

IUPAC1-ethyl-2-pyrazol-1-yl-2H-pyridine
SMILESCCN1C=CC=CC1n1cccn1
InChIInChI=1S/C10H13N3/c1-2-12-8-4-3-6-10(12)13-9-5-7-11-13/h3-10H,2H2,1H3
InChIKeyBLRLZPHLXPXDAP-UHFFFAOYSA-N
MW175.23 g/mol
LogP1.79
Rot. Bonds2

About 1-ethyl-2-pyrazol-1-yl-2H-pyridine

1-ethyl-2-pyrazol-1-yl-2H-pyridine (PubChem CID 18174949) has the molecular formula C10H13N3 and a molecular weight of 175.23 g/mol. Its IUPAC name is 1-ethyl-2-pyrazol-1-yl-2H-pyridine.

Molecular Properties

Compound Name1-ethyl-2-pyrazol-1-yl-2H-pyridine
PubChem CID18174949
Molecular FormulaC10H13N3
Molecular Weight175.23 g/mol
Exact Mass175.11
IUPAC Name1-ethyl-2-pyrazol-1-yl-2H-pyridine
SMILESCCN1C=CC=CC1n1cccn1
InChIInChI=1S/C10H13N3/c1-2-12-8-4-3-6-10(12)13-9-5-7-11-13/h3-10H,2H2,1H3
InChIKeyBLRLZPHLXPXDAP-UHFFFAOYSA-N
XLogP1.79
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-Ethylpyrazole
CID 498446
1-(prop-2-en-1-yl)-1H-pyrazole
CID 3489293
1-Propyl-1H-pyrazole
CID 12711096
1-butyl-1H-pyrazole
CID 142906
1,2-Dimethylpyrazol-2-ium
CID 419192
1,1'-propane-2,2-diylbis(1H-pyrazole)
CID 10921041
N,N-Dimethyl-2-(1H-pyrazol-1-yl)ethan-1-amine
CID 52141940
1-Ethyl-2-methylpyrazol-2-ium
CID 549401
Bis(pyrazole-1-yl)ethane
CID 5245495
1-(2,2-dimethyl-propyl)-1H-pyrazole
CID 23088349
1-Propyl-2-methylpyrazolium iodide
CID 118411556
Pentadeuterioethyl 1h pyrazol
CID 129814734

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-pyrazol-1-yl-2H-pyridine?
The IUPAC name of 1-ethyl-2-pyrazol-1-yl-2H-pyridine (CID 18174949) is 1-ethyl-2-pyrazol-1-yl-2H-pyridine.
What is the SMILES notation for 1-ethyl-2-pyrazol-1-yl-2H-pyridine?
The canonical SMILES for 1-ethyl-2-pyrazol-1-yl-2H-pyridine is CCN1C=CC=CC1n1cccn1.
What is the InChIKey of 1-ethyl-2-pyrazol-1-yl-2H-pyridine?
The InChIKey is BLRLZPHLXPXDAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-2-12-8-4-3-6-10(12)13-9-5-7-11-13/h3-10H,2H2,1H3.
What are the key properties of 1-ethyl-2-pyrazol-1-yl-2H-pyridine?
1-ethyl-2-pyrazol-1-yl-2H-pyridine has a molecular weight of 175.23 g/mol, XLogP of 1.79, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-pyrazol-1-yl-2H-pyridine is sourced from PubChem (CID 18174949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).