carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride

C17H16Cl2N4O3 — CID 158726702

IUPACcarbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride
SMILESCl.Clc1ccc(-n2nc(N3CCOCC3)c3ccncc32)cc1.O=C=O
InChIInChI=1S/C16H15ClN4O.CO2.ClH/c17-12-1-3-13(4-2-12)21-15-11-18-6-5-14(15)16(19-21)20-7-9-22-10-8-20;2-1-3;/h1-6,11H,7-10H2;;1H
InChIKeyMTZNPHFGSGNAOA-UHFFFAOYSA-N
MW395.25 g/mol
LogP2.75
Rot. Bonds2

About carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride

carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride (PubChem CID 158726702) has the molecular formula C17H16Cl2N4O3 and a molecular weight of 395.25 g/mol. Its IUPAC name is carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride.

Molecular Properties

Compound Namecarbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride
PubChem CID158726702
Molecular FormulaC17H16Cl2N4O3
Molecular Weight395.25 g/mol
Exact Mass394.06
IUPAC Namecarbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride
SMILESCl.Clc1ccc(-n2nc(N3CCOCC3)c3ccncc32)cc1.O=C=O
InChIInChI=1S/C16H15ClN4O.CO2.ClH/c17-12-1-3-13(4-2-12)21-15-11-18-6-5-14(15)16(19-21)20-7-9-22-10-8-20;2-1-3;/h1-6,11H,7-10H2;;1H
InChIKeyMTZNPHFGSGNAOA-UHFFFAOYSA-N
XLogP2.75
TPSA77.32 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.25
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

1-(4-chlorophenyl)-3-(4-methylpiperidin-1-yl)pyrazolo[5,4-c]pyridine
CID 140654566
4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine-3-carboxylic acid
CID 89440941
N-(2-aminoethyl)-1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-4-carboxamide
CID 71516167
3-aminopropyl 4-[[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methyl]piperazine-1-carboxylate;trihydrochloride
CID 140654567
[4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-2-yl]methanol
CID 71516230
1-(4-chlorophenyl)-3-(3,3-difluoropyrrolidin-1-yl)pyrazolo[5,4-c]pyridine;1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-ol;1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]pyrrolidin-3-ol;4-[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;1-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-4-carboxamide;1-(6-methyl-3-pyridinyl)-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine
CID 161144032
N-(2-aminoethyl)-4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine-3-carboxamide
CID 67418601
1-[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-3-(1-methylpiperidin-4-yl)propan-1-one
CID 157374976
4-[1-(4-chlorophenyl)-7,8-dihydrocycloocta[c]pyrazol-3-yl]morpholine
CID 123918313
N-(2-aminoethyl)-2-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholin-3-yl]acetamide;1-(4-chlorophenyl)-3-[4-(piperazin-1-ylmethyl)piperidin-1-yl]pyrazolo[5,4-c]pyridine;4-[[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]methyl]morpholine;N-[[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]methyl]-1-piperidin-4-ylmethanamine;1-[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-yl]-3-(1-methylpiperidin-4-yl)propan-1-one
CID 157374975
4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidine-1-carboxamide;4-propylmorpholine
CID 144974958
4-(4-pyridin-4-ylphenyl)morpholine
CID 91005781

Frequently Asked Questions

What is the IUPAC name of carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride?
The IUPAC name of carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride (CID 158726702) is carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride.
What is the SMILES notation for carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride?
The canonical SMILES for carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride is Cl.Clc1ccc(-n2nc(N3CCOCC3)c3ccncc32)cc1.O=C=O.
What is the InChIKey of carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride?
The InChIKey is MTZNPHFGSGNAOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN4O.CO2.ClH/c17-12-1-3-13(4-2-12)21-15-11-18-6-5-14(15)16(19-21)20-7-9-22-10-8-20;2-1-3;/h1-6,11H,7-10H2;;1H.
What are the key properties of carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride?
carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride has a molecular weight of 395.25 g/mol, XLogP of 2.75, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for carbon dioxide;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;hydrochloride is sourced from PubChem (CID 158726702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).