5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine

C11H20N4O — CID 135306057

IUPAC5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine
SMILESCOCCN1CCC(c2cc(N)n[nH]2)CC1
InChIInChI=1S/C11H20N4O/c1-16-7-6-15-4-2-9(3-5-15)10-8-11(12)14-13-10/h8-9H,2-7H2,1H3,(H3,12,13,14)
InChIKeySBLRZGJADVJNGH-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.82
Rot. Bonds4

About 5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine

5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine (PubChem CID 135306057) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine
PubChem CID135306057
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine
SMILESCOCCN1CCC(c2cc(N)n[nH]2)CC1
InChIInChI=1S/C11H20N4O/c1-16-7-6-15-4-2-9(3-5-15)10-8-11(12)14-13-10/h8-9H,2-7H2,1H3,(H3,12,13,14)
InChIKeySBLRZGJADVJNGH-UHFFFAOYSA-N
XLogP0.82
TPSA67.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine?
The IUPAC name of 5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine (CID 135306057) is 5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine.
What is the SMILES notation for 5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine?
The canonical SMILES for 5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine is COCCN1CCC(c2cc(N)n[nH]2)CC1.
What is the InChIKey of 5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine?
The InChIKey is SBLRZGJADVJNGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-16-7-6-15-4-2-9(3-5-15)10-8-11(12)14-13-10/h8-9H,2-7H2,1H3,(H3,12,13,14).
What are the key properties of 5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine?
5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine has a molecular weight of 224.31 g/mol, XLogP of 0.82, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(2-methoxyethyl)piperidin-4-yl]-1H-pyrazol-3-amine is sourced from PubChem (CID 135306057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).