5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine

C18H24N4 — CID 28907589

IUPAC5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine
SMILESNc1c2c(nn1-c1ccccc1)CCN(C1CCCCC1)C2
InChIInChI=1S/C18H24N4/c19-18-16-13-21(14-7-3-1-4-8-14)12-11-17(16)20-22(18)15-9-5-2-6-10-15/h2,5-6,9-10,14H,1,3-4,7-8,11-13,19H2
InChIKeyWLSMFBWCVVQPNM-UHFFFAOYSA-N
MW296.42 g/mol
LogP3.15
Rot. Bonds2

About 5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine

5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine (PubChem CID 28907589) has the molecular formula C18H24N4 and a molecular weight of 296.42 g/mol. Its IUPAC name is 5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine.

Molecular Properties

Compound Name5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine
PubChem CID28907589
Molecular FormulaC18H24N4
Molecular Weight296.42 g/mol
Exact Mass296.20
IUPAC Name5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine
SMILESNc1c2c(nn1-c1ccccc1)CCN(C1CCCCC1)C2
InChIInChI=1S/C18H24N4/c19-18-16-13-21(14-7-3-1-4-8-14)12-11-17(16)20-22(18)15-9-5-2-6-10-15/h2,5-6,9-10,14H,1,3-4,7-8,11-13,19H2
InChIKeyWLSMFBWCVVQPNM-UHFFFAOYSA-N
XLogP3.15
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine?
The IUPAC name of 5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine (CID 28907589) is 5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine.
What is the SMILES notation for 5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine?
The canonical SMILES for 5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine is Nc1c2c(nn1-c1ccccc1)CCN(C1CCCCC1)C2.
What is the InChIKey of 5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine?
The InChIKey is WLSMFBWCVVQPNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4/c19-18-16-13-21(14-7-3-1-4-8-14)12-11-17(16)20-22(18)15-9-5-2-6-10-15/h2,5-6,9-10,14H,1,3-4,7-8,11-13,19H2.
What are the key properties of 5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine?
5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine has a molecular weight of 296.42 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-2-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine is sourced from PubChem (CID 28907589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).