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

C12H20N4O — CID 105498001

IUPAC[1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine
SMILESNCc1nn(C2CCOCC2)c2c1CNCC2
InChIInChI=1S/C12H20N4O/c13-7-11-10-8-14-4-1-12(10)16(15-11)9-2-5-17-6-3-9/h9,14H,1-8,13H2
InChIKeyUVMWXEDCMDNIHI-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.34
Rot. Bonds2

About [1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine

[1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine (PubChem CID 105498001) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is [1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine
PubChem CID105498001
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name[1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine
SMILESNCc1nn(C2CCOCC2)c2c1CNCC2
InChIInChI=1S/C12H20N4O/c13-7-11-10-8-14-4-1-12(10)16(15-11)9-2-5-17-6-3-9/h9,14H,1-8,13H2
InChIKeyUVMWXEDCMDNIHI-UHFFFAOYSA-N
XLogP0.34
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(oxan-4-yl)-4,5,6,7-tetrahydroindazol-3-yl]methanamine
CID 105496814
(1-piperidin-4-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-yl)methanamine
CID 105498003
2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine
CID 105479436
1-cycloheptyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine
CID 105495321
2-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carbaldehyde
CID 105496416
1-cyclopropyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 69193043
[1-(1-methylpiperidin-4-yl)-4,6-dihydrofuro[3,4-d]pyrazol-3-yl]methanamine
CID 105498006
3-chloro-1-(oxolan-3-yl)-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine
CID 105485038
3-(benzimidazol-1-ylmethyl)-1-piperidin-4-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 110459126
3-cyclohexyl-1-piperidin-4-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 82587575
1-(oxan-4-yl)-5,7-dihydro-4H-pyrano[4,3-d]pyrazol-3-amine
CID 105480660
(2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine
CID 105459638

Frequently Asked Questions

What is the IUPAC name of [1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine?
The IUPAC name of [1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine (CID 105498001) is [1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine.
What is the SMILES notation for [1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine?
The canonical SMILES for [1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine is NCc1nn(C2CCOCC2)c2c1CNCC2.
What is the InChIKey of [1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine?
The InChIKey is UVMWXEDCMDNIHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c13-7-11-10-8-14-4-1-12(10)16(15-11)9-2-5-17-6-3-9/h9,14H,1-8,13H2.
What are the key properties of [1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine?
[1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine has a molecular weight of 236.32 g/mol, XLogP of 0.34, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(oxan-4-yl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanamine is sourced from PubChem (CID 105498001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).