1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine

C11H14N4O — CID 90037704

IUPAC1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine
SMILESCOc1ccc(C(C)n2cc(N)cn2)cn1
InChIInChI=1S/C11H14N4O/c1-8(15-7-10(12)6-14-15)9-3-4-11(16-2)13-5-9/h3-8H,12H2,1-2H3
InChIKeyPGEZNEFADCXSJQ-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.48
Rot. Bonds3

About 1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine

1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine (PubChem CID 90037704) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine
PubChem CID90037704
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine
SMILESCOc1ccc(C(C)n2cc(N)cn2)cn1
InChIInChI=1S/C11H14N4O/c1-8(15-7-10(12)6-14-15)9-3-4-11(16-2)13-5-9/h3-8H,12H2,1-2H3
InChIKeyPGEZNEFADCXSJQ-UHFFFAOYSA-N
XLogP1.48
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine?
The IUPAC name of 1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine (CID 90037704) is 1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine.
What is the SMILES notation for 1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine?
The canonical SMILES for 1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine is COc1ccc(C(C)n2cc(N)cn2)cn1.
What is the InChIKey of 1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine?
The InChIKey is PGEZNEFADCXSJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-8(15-7-10(12)6-14-15)9-3-4-11(16-2)13-5-9/h3-8H,12H2,1-2H3.
What are the key properties of 1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine?
1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine has a molecular weight of 218.26 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine is sourced from PubChem (CID 90037704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).