2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine

C12H18N4O — CID 105494782

IUPAC2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
SMILESNc1c2c(nn1C1CN(C3CC3)C1)COCC2
InChIInChI=1S/C12H18N4O/c13-12-10-3-4-17-7-11(10)14-16(12)9-5-15(6-9)8-1-2-8/h8-9H,1-7,13H2
InChIKeyCRZMEPHXOOZUKY-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.56
Rot. Bonds2

About 2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine

2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine (PubChem CID 105494782) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine.

Molecular Properties

Compound Name2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
PubChem CID105494782
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
SMILESNc1c2c(nn1C1CN(C3CC3)C1)COCC2
InChIInChI=1S/C12H18N4O/c13-12-10-3-4-17-7-11(10)14-16(12)9-5-15(6-9)8-1-2-8/h8-9H,1-7,13H2
InChIKeyCRZMEPHXOOZUKY-UHFFFAOYSA-N
XLogP0.56
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-cyclopropyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
CID 105438145
2-(oxan-4-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
CID 105480663
2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
CID 105478038
2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine
CID 105438148
2-tert-butyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
CID 105449274
(2-piperidin-4-yl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl)methanamine
CID 105498018
2-cyclopentyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazole-3-carbaldehyde
CID 105475688
2-(1-ethylazetidin-3-yl)-4,5,6,7-tetrahydroindazol-3-amine
CID 105476651
2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine
CID 105479436
1-(oxan-4-yl)-5,7-dihydro-4H-pyrano[4,3-d]pyrazol-3-amine
CID 105480660
2-(oxetan-3-yl)-5,7-dihydro-4H-thiopyrano[3,4-c]pyrazol-3-amine
CID 105465137
2-(1-ethylazetidin-3-yl)-6-methyl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridin-3-amine
CID 105496879

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine?
The IUPAC name of 2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine (CID 105494782) is 2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine.
What is the SMILES notation for 2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine?
The canonical SMILES for 2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine is Nc1c2c(nn1C1CN(C3CC3)C1)COCC2.
What is the InChIKey of 2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine?
The InChIKey is CRZMEPHXOOZUKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c13-12-10-3-4-17-7-11(10)14-16(12)9-5-15(6-9)8-1-2-8/h8-9H,1-7,13H2.
What are the key properties of 2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine?
2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine has a molecular weight of 234.30 g/mol, XLogP of 0.56, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine is sourced from PubChem (CID 105494782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).