1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine

C11H17N3O — CID 105460864

IUPAC1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine
SMILESNC1(c2cc(C3CCOCC3)[nH]n2)CC1
InChIInChI=1S/C11H17N3O/c12-11(3-4-11)10-7-9(13-14-10)8-1-5-15-6-2-8/h7-8H,1-6,12H2,(H,13,14)
InChIKeyQKXHXAOGBWQOTK-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.25
Rot. Bonds2

About 1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine

1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine (PubChem CID 105460864) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine
PubChem CID105460864
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine
SMILESNC1(c2cc(C3CCOCC3)[nH]n2)CC1
InChIInChI=1S/C11H17N3O/c12-11(3-4-11)10-7-9(13-14-10)8-1-5-15-6-2-8/h7-8H,1-6,12H2,(H,13,14)
InChIKeyQKXHXAOGBWQOTK-UHFFFAOYSA-N
XLogP1.25
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-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-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine?
The IUPAC name of 1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine (CID 105460864) is 1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine.
What is the SMILES notation for 1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine?
The canonical SMILES for 1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine is NC1(c2cc(C3CCOCC3)[nH]n2)CC1.
What is the InChIKey of 1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine?
The InChIKey is QKXHXAOGBWQOTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c12-11(3-4-11)10-7-9(13-14-10)8-1-5-15-6-2-8/h7-8H,1-6,12H2,(H,13,14).
What are the key properties of 1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine?
1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine has a molecular weight of 207.28 g/mol, XLogP of 1.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(oxan-4-yl)-1H-pyrazol-3-yl]cyclopropan-1-amine is sourced from PubChem (CID 105460864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).