1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone

C14H23N5O2 — CID 122509008

IUPAC1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone
SMILESNc1cc(C2CCN(C(=O)CN3CCOCC3)CC2)[nH]n1
InChIInChI=1S/C14H23N5O2/c15-13-9-12(16-17-13)11-1-3-19(4-2-11)14(20)10-18-5-7-21-8-6-18/h9,11H,1-8,10H2,(H3,15,16,17)
InChIKeyGDZULHKZXCCGNR-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.03
Rot. Bonds3

About 1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone

1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone (PubChem CID 122509008) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone.

Molecular Properties

Compound Name1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone
PubChem CID122509008
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC Name1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone
SMILESNc1cc(C2CCN(C(=O)CN3CCOCC3)CC2)[nH]n1
InChIInChI=1S/C14H23N5O2/c15-13-9-12(16-17-13)11-1-3-19(4-2-11)14(20)10-18-5-7-21-8-6-18/h9,11H,1-8,10H2,(H3,15,16,17)
InChIKeyGDZULHKZXCCGNR-UHFFFAOYSA-N
XLogP0.03
TPSA87.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone?
The IUPAC name of 1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone (CID 122509008) is 1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone.
What is the SMILES notation for 1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone?
The canonical SMILES for 1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone is Nc1cc(C2CCN(C(=O)CN3CCOCC3)CC2)[nH]n1.
What is the InChIKey of 1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone?
The InChIKey is GDZULHKZXCCGNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2/c15-13-9-12(16-17-13)11-1-3-19(4-2-11)14(20)10-18-5-7-21-8-6-18/h9,11H,1-8,10H2,(H3,15,16,17).
What are the key properties of 1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone?
1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone has a molecular weight of 293.37 g/mol, XLogP of 0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(3-amino-1H-pyrazol-5-yl)piperidin-1-yl]-2-morpholin-4-ylethanone is sourced from PubChem (CID 122509008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).