N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine

C18H24N6 — CID 46913411

IUPACN-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine
SMILESCC(C)n1cc(-c2n[nH]c3ccnc(NC4CCCCC4)c23)cn1
InChIInChI=1S/C18H24N6/c1-12(2)24-11-13(10-20-24)17-16-15(22-23-17)8-9-19-18(16)21-14-6-4-3-5-7-14/h8-12,14H,3-7H2,1-2H3,(H,19,21)(H,22,23)
InChIKeyDSJVHGIGHUECMD-UHFFFAOYSA-N
MW324.43 g/mol
LogP4.15
Rot. Bonds4

About N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine

N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine (PubChem CID 46913411) has the molecular formula C18H24N6 and a molecular weight of 324.43 g/mol. Its IUPAC name is N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine.

Molecular Properties

Compound NameN-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine
PubChem CID46913411
Molecular FormulaC18H24N6
Molecular Weight324.43 g/mol
Exact Mass324.21
IUPAC NameN-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine
SMILESCC(C)n1cc(-c2n[nH]c3ccnc(NC4CCCCC4)c23)cn1
InChIInChI=1S/C18H24N6/c1-12(2)24-11-13(10-20-24)17-16-15(22-23-17)8-9-19-18(16)21-14-6-4-3-5-7-14/h8-12,14H,3-7H2,1-2H3,(H,19,21)(H,22,23)
InChIKeyDSJVHGIGHUECMD-UHFFFAOYSA-N
XLogP4.15
TPSA71.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine?
The IUPAC name of N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine (CID 46913411) is N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine.
What is the SMILES notation for N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine?
The canonical SMILES for N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine is CC(C)n1cc(-c2n[nH]c3ccnc(NC4CCCCC4)c23)cn1.
What is the InChIKey of N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine?
The InChIKey is DSJVHGIGHUECMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6/c1-12(2)24-11-13(10-20-24)17-16-15(22-23-17)8-9-19-18(16)21-14-6-4-3-5-7-14/h8-12,14H,3-7H2,1-2H3,(H,19,21)(H,22,23).
What are the key properties of N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine?
N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine has a molecular weight of 324.43 g/mol, XLogP of 4.15, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine is sourced from PubChem (CID 46913411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).