2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine

C11H18N4O — CID 105479436

IUPAC2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine
SMILESNc1c2c(nn1C1CCOCC1)CCNC2
InChIInChI=1S/C11H18N4O/c12-11-9-7-13-4-1-10(9)14-15(11)8-2-5-16-6-3-8/h8,13H,1-7,12H2
InChIKeySBIWOEOXRRYDDP-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.46
Rot. Bonds1

About 2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine

2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine (PubChem CID 105479436) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine.

Molecular Properties

Compound Name2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine
PubChem CID105479436
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine
SMILESNc1c2c(nn1C1CCOCC1)CCNC2
InChIInChI=1S/C11H18N4O/c12-11-9-7-13-4-1-10(9)14-15(11)8-2-5-16-6-3-8/h8,13H,1-7,12H2
InChIKeySBIWOEOXRRYDDP-UHFFFAOYSA-N
XLogP0.46
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-pyrrolidin-3-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine
CID 105460873
2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carbaldehyde
CID 105496416
2-(oxan-4-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
CID 105480663
2-cyclobutyl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazol-3-amine
CID 105437712
2-cyclopropyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine
CID 105438148
2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine
CID 105495335
[1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine
CID 105498001
2-cyclopropyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
CID 105438145
2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
CID 105478038
2-piperidin-4-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carbaldehyde
CID 105494791
2-(oxan-4-yl)-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carbonitrile
CID 105471198
2-(1-cyclopropylazetidin-3-yl)-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
CID 105494782

Frequently Asked Questions

What is the IUPAC name of 2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine?
The IUPAC name of 2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine (CID 105479436) is 2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine.
What is the SMILES notation for 2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine?
The canonical SMILES for 2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine is Nc1c2c(nn1C1CCOCC1)CCNC2.
What is the InChIKey of 2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine?
The InChIKey is SBIWOEOXRRYDDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c12-11-9-7-13-4-1-10(9)14-15(11)8-2-5-16-6-3-8/h8,13H,1-7,12H2.
What are the key properties of 2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine?
2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine has a molecular weight of 222.29 g/mol, XLogP of 0.46, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine is sourced from PubChem (CID 105479436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).