piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone

C19H18N6O — CID 168772513

IUPACpiperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone
SMILESO=C(c1cnn2ccc(-c3c[nH]c4ncncc34)cc12)N1CCCCC1
InChIInChI=1S/C19H18N6O/c26-19(24-5-2-1-3-6-24)16-11-23-25-7-4-13(8-17(16)25)14-10-21-18-15(14)9-20-12-22-18/h4,7-12H,1-3,5-6H2,(H,20,21,22)
InChIKeyRPCNXRFXGUNOTG-UHFFFAOYSA-N
MW346.39 g/mol
LogP2.90
Rot. Bonds2

About piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone

piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone (PubChem CID 168772513) has the molecular formula C19H18N6O and a molecular weight of 346.39 g/mol. Its IUPAC name is piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone.

Molecular Properties

Compound Namepiperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone
PubChem CID168772513
Molecular FormulaC19H18N6O
Molecular Weight346.39 g/mol
Exact Mass346.15
IUPAC Namepiperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone
SMILESO=C(c1cnn2ccc(-c3c[nH]c4ncncc34)cc12)N1CCCCC1
InChIInChI=1S/C19H18N6O/c26-19(24-5-2-1-3-6-24)16-11-23-25-7-4-13(8-17(16)25)14-10-21-18-15(14)9-20-12-22-18/h4,7-12H,1-3,5-6H2,(H,20,21,22)
InChIKeyRPCNXRFXGUNOTG-UHFFFAOYSA-N
XLogP2.90
TPSA79.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 175879498
[5-[2-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]methylamino]-7H-pyrrolo[2,3-d]pyrimidin-5-yl]pyrazolo[1,5-a]pyridin-3-yl]-piperidin-1-ylmethanone
CID 168773776
5-[2-(3,3,3-trifluoropropyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 175879534
pyrazolo[1,5-a]pyrazin-3-yl(pyrrolidin-1-yl)methanone
CID 103120002
2,2,2-trifluoro-1-[4-[3-(pyrrolidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidin-1-yl]ethanone
CID 53041288
5-(2-cyclopropyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)-N-(3,3-difluorocyclobutyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide
CID 168773574
N-(2,2-difluoroethyl)-5-[2-[[1-(trifluoromethyl)cyclopropyl]methylamino]-7H-pyrrolo[2,3-d]pyrimidin-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 168773337
N-(2,2-difluoroethyl)-5-[2-[(4-methoxycyclohexyl)amino]-7H-pyrrolo[2,3-d]pyrimidin-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 168772563
N-(4-methoxycyclohexyl)-5-[2-[(4-methoxycyclohexyl)amino]-7H-pyrrolo[2,3-d]pyrimidin-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 168774063
5-[2-(cyclobutylmethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]-N-(3,3-difluorocyclobutyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 168773533
N-(2-fluoro-2-methylpropyl)-5-[2-(2,2,2-trifluoroethylamino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 168773621
N-pyridin-3-yl-5-[2-(3,3,3-trifluoropropyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 168774056

Frequently Asked Questions

What is the IUPAC name of piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone?
The IUPAC name of piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone (CID 168772513) is piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone.
What is the SMILES notation for piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone?
The canonical SMILES for piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone is O=C(c1cnn2ccc(-c3c[nH]c4ncncc34)cc12)N1CCCCC1.
What is the InChIKey of piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone?
The InChIKey is RPCNXRFXGUNOTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6O/c26-19(24-5-2-1-3-6-24)16-11-23-25-7-4-13(8-17(16)25)14-10-21-18-15(14)9-20-12-22-18/h4,7-12H,1-3,5-6H2,(H,20,21,22).
What are the key properties of piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone?
piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone has a molecular weight of 346.39 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-1-yl-[5-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrazolo[1,5-a]pyridin-3-yl]methanone is sourced from PubChem (CID 168772513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).