2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine

C9H13N3O — CID 105438148

IUPAC2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine
SMILESNc1c2c(nn1C1CC1)CCOC2
InChIInChI=1S/C9H13N3O/c10-9-7-5-13-4-3-8(7)11-12(9)6-1-2-6/h6H,1-5,10H2
InChIKeyPHXOEEXQLGQRKC-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.87
Rot. Bonds1

About 2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine

2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine (PubChem CID 105438148) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine.

Molecular Properties

Compound Name2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine
PubChem CID105438148
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine
SMILESNc1c2c(nn1C1CC1)CCOC2
InChIInChI=1S/C9H13N3O/c10-9-7-5-13-4-3-8(7)11-12(9)6-1-2-6/h6H,1-5,10H2
InChIKeyPHXOEEXQLGQRKC-UHFFFAOYSA-N
XLogP0.87
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine?
The IUPAC name of 2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine (CID 105438148) is 2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine.
What is the SMILES notation for 2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine?
The canonical SMILES for 2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine is Nc1c2c(nn1C1CC1)CCOC2.
What is the InChIKey of 2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine?
The InChIKey is PHXOEEXQLGQRKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c10-9-7-5-13-4-3-8(7)11-12(9)6-1-2-6/h6H,1-5,10H2.
What are the key properties of 2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine?
2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine has a molecular weight of 179.22 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine is sourced from PubChem (CID 105438148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).