2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine

C12H19N3O — CID 105478038

IUPAC2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
SMILESNc1c2c(nn1C1CCCCC1)COCC2
InChIInChI=1S/C12H19N3O/c13-12-10-6-7-16-8-11(10)14-15(12)9-4-2-1-3-5-9/h9H,1-8,13H2
InChIKeyAISSNVKQONSJJH-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.04
Rot. Bonds1

About 2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine

2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine (PubChem CID 105478038) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine.

Molecular Properties

Compound Name2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
PubChem CID105478038
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
SMILESNc1c2c(nn1C1CCCCC1)COCC2
InChIInChI=1S/C12H19N3O/c13-12-10-6-7-16-8-11(10)14-15(12)9-4-2-1-3-5-9/h9H,1-8,13H2
InChIKeyAISSNVKQONSJJH-UHFFFAOYSA-N
XLogP2.04
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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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-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
CID 105494782
2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine
CID 105438148
2-cyclopentyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazole-3-carbaldehyde
CID 105475688
2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine
CID 105495335
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-cycloheptyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile
CID 105489761
2-cyclopentyl-6-ethyl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridin-3-amine
CID 105495296
2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine
CID 105479436
2-cyclobutyl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazol-3-amine
CID 105437712

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine?
The IUPAC name of 2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine (CID 105478038) is 2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine.
What is the SMILES notation for 2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine?
The canonical SMILES for 2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine is Nc1c2c(nn1C1CCCCC1)COCC2.
What is the InChIKey of 2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine?
The InChIKey is AISSNVKQONSJJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c13-12-10-6-7-16-8-11(10)14-15(12)9-4-2-1-3-5-9/h9H,1-8,13H2.
What are the key properties of 2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine?
2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine has a molecular weight of 221.30 g/mol, XLogP of 2.04, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine is sourced from PubChem (CID 105478038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).