2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine

C13H22N4 — CID 105495335

IUPAC2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine
SMILESNc1c2c(nn1C1CCCCCC1)CNCC2
InChIInChI=1S/C13H22N4/c14-13-11-7-8-15-9-12(11)16-17(13)10-5-3-1-2-4-6-10/h10,15H,1-9,14H2
InChIKeyOCYKHBJMBPFWPE-UHFFFAOYSA-N
MW234.35 g/mol
LogP2.01
Rot. Bonds1

About 2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine

2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine (PubChem CID 105495335) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine.

Molecular Properties

Compound Name2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine
PubChem CID105495335
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine
SMILESNc1c2c(nn1C1CCCCCC1)CNCC2
InChIInChI=1S/C13H22N4/c14-13-11-7-8-15-9-12(11)16-17(13)10-5-3-1-2-4-6-10/h10,15H,1-9,14H2
InChIKeyOCYKHBJMBPFWPE-UHFFFAOYSA-N
XLogP2.01
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclobutyl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazol-3-amine
CID 105437712
(2-cyclobutyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanamine
CID 105459638
2-cyclopentyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine-3-carboxylic acid
CID 105496410
2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
CID 105478038
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-pyrrolidin-3-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-amine
CID 105460873
1-cyclobutyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridin-3-amine
CID 105446509
1-cycloheptyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856291
2-cyclopentyl-6-ethyl-5,7-dihydro-4H-pyrazolo[3,4-c]pyridin-3-amine
CID 105495296
2-cyclopentyl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole-3-carboxylic acid
CID 105477534
2-cyclopropyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
CID 105438145

Frequently Asked Questions

What is the IUPAC name of 2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine?
The IUPAC name of 2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine (CID 105495335) is 2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine.
What is the SMILES notation for 2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine?
The canonical SMILES for 2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine is Nc1c2c(nn1C1CCCCCC1)CNCC2.
What is the InChIKey of 2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine?
The InChIKey is OCYKHBJMBPFWPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c14-13-11-7-8-15-9-12(11)16-17(13)10-5-3-1-2-4-6-10/h10,15H,1-9,14H2.
What are the key properties of 2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine?
2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine has a molecular weight of 234.35 g/mol, XLogP of 2.01, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cycloheptyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-amine is sourced from PubChem (CID 105495335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).