4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine

C15H18N6 — CID 165156769

IUPAC4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine
SMILESNc1cnc2[nH]cc(-c3ccn[nH]3)c2c1N1CCCCC1
InChIInChI=1S/C15H18N6/c16-11-9-18-15-13(14(11)21-6-2-1-3-7-21)10(8-17-15)12-4-5-19-20-12/h4-5,8-9H,1-3,6-7,16H2,(H,17,18)(H,19,20)
InChIKeyMFGGOUDCVSWDFW-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.53
Rot. Bonds2

About 4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine

4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine (PubChem CID 165156769) has the molecular formula C15H18N6 and a molecular weight of 282.35 g/mol. Its IUPAC name is 4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine.

Molecular Properties

Compound Name4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine
PubChem CID165156769
Molecular FormulaC15H18N6
Molecular Weight282.35 g/mol
Exact Mass282.16
IUPAC Name4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine
SMILESNc1cnc2[nH]cc(-c3ccn[nH]3)c2c1N1CCCCC1
InChIInChI=1S/C15H18N6/c16-11-9-18-15-13(14(11)21-6-2-1-3-7-21)10(8-17-15)12-4-5-19-20-12/h4-5,8-9H,1-3,6-7,16H2,(H,17,18)(H,19,20)
InChIKeyMFGGOUDCVSWDFW-UHFFFAOYSA-N
XLogP2.53
TPSA86.62 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(3S)-3-ethylpiperidin-1-yl]-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridine
CID 167687788
5-(2-pyrrolidin-1-ylphenyl)-1H-pyrazole
CID 138542816
2-[4-(1H-pyrazol-5-yl)phenyl]-3-pyrrolidin-1-ylpyrazine
CID 77095916
5-(1-hydroxypyridin-1-ium-3-yl)-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridine
CID 147217428
2-amino-4-pyrrolidin-1-yl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
CID 118708945
3-[2-(azepan-1-yl)pyrimidin-4-yl]-5-chloro-1H-pyrrolo[2,3-b]pyridine
CID 11587926
N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine
CID 123958418
3-[3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenol
CID 135983722
6-bromo-4-pyrrolidin-1-ylquinolin-3-amine
CID 43621123
6-[4-[(3R)-3-(methylamino)piperidin-1-yl]-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridin-3-amine
CID 165156679
5-(3-pyrrolidin-1-ylphenyl)-1H-pyrazole
CID 141365895
2-(azocan-1-yl)pyridin-3-amine
CID 28799710

Frequently Asked Questions

What is the IUPAC name of 4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine?
The IUPAC name of 4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine (CID 165156769) is 4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine.
What is the SMILES notation for 4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine?
The canonical SMILES for 4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine is Nc1cnc2[nH]cc(-c3ccn[nH]3)c2c1N1CCCCC1.
What is the InChIKey of 4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine?
The InChIKey is MFGGOUDCVSWDFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6/c16-11-9-18-15-13(14(11)21-6-2-1-3-7-21)10(8-17-15)12-4-5-19-20-12/h4-5,8-9H,1-3,6-7,16H2,(H,17,18)(H,19,20).
What are the key properties of 4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine?
4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine has a molecular weight of 282.35 g/mol, XLogP of 2.53, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-1-yl-3-(1H-pyrazol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-amine is sourced from PubChem (CID 165156769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).