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

C11H18N4 — CID 105459638

IUPAC(2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine
SMILESNCc1c2c(nn1C1CCC1)CNCC2
InChIInChI=1S/C11H18N4/c12-6-11-9-4-5-13-7-10(9)14-15(11)8-2-1-3-8/h8,13H,1-7,12H2
InChIKeyGAXGFEJNPWKZSD-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.71
Rot. Bonds2

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

(2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine (PubChem CID 105459638) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is (2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine.

Molecular Properties

Compound Name(2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine
PubChem CID105459638
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name(2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine
SMILESNCc1c2c(nn1C1CCC1)CNCC2
InChIInChI=1S/C11H18N4/c12-6-11-9-4-5-13-7-10(9)14-15(11)8-2-1-3-8/h8,13H,1-7,12H2
InChIKeyGAXGFEJNPWKZSD-UHFFFAOYSA-N
XLogP0.71
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2-cycloheptyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanamine
CID 105493701
2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine
CID 105495335
(2-piperidin-4-yl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl)methanamine
CID 105498018
(2-cyclopentyl-6-methyl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridin-3-yl)methanamine
CID 105495336
2-cyclobutyl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazol-3-amine
CID 105437712
2-cyclopentyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine-3-carboxylic acid
CID 105496410
1-cyclobutyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridin-3-amine
CID 105446509
3-chloro-1-cyclobutyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine
CID 105465676
1-piperidin-3-yl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridin-3-amine
CID 105478139
1-cycloheptyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine
CID 105495321
2-cyclopentyl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole-3-carboxylic acid
CID 105477534
2-pyrrolidin-3-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine
CID 105460873

Frequently Asked Questions

What is the IUPAC name of (2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine?
The IUPAC name of (2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine (CID 105459638) is (2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine.
What is the SMILES notation for (2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine?
The canonical SMILES for (2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine is NCc1c2c(nn1C1CCC1)CNCC2.
What is the InChIKey of (2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine?
The InChIKey is GAXGFEJNPWKZSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c12-6-11-9-4-5-13-7-10(9)14-15(11)8-2-1-3-8/h8,13H,1-7,12H2.
What are the key properties of (2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine?
(2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine has a molecular weight of 206.29 g/mol, XLogP of 0.71, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine is sourced from PubChem (CID 105459638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).