N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide

C24H23N5O3 — CID 66829113

IUPACN-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2cc(-c3n[nH]c4ccnc(OC5CCOCC5)c34)ccn2)c1
InChIInChI=1S/C24H23N5O3/c1-15(30)27-18-4-2-3-16(13-18)21-14-17(5-9-25-21)23-22-20(28-29-23)6-10-26-24(22)32-19-7-11-31-12-8-19/h2-6,9-10,13-14,19H,7-8,11-12H2,1H3,(H,27,30)(H,28,29)
InChIKeyGAPJEXXXNXCKDE-UHFFFAOYSA-N
MW429.48 g/mol
LogP4.20
Rot. Bonds5

About N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide

N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide (PubChem CID 66829113) has the molecular formula C24H23N5O3 and a molecular weight of 429.48 g/mol. Its IUPAC name is N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide
PubChem CID66829113
Molecular FormulaC24H23N5O3
Molecular Weight429.48 g/mol
Exact Mass429.18
IUPAC NameN-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2cc(-c3n[nH]c4ccnc(OC5CCOCC5)c34)ccn2)c1
InChIInChI=1S/C24H23N5O3/c1-15(30)27-18-4-2-3-16(13-18)21-14-17(5-9-25-21)23-22-20(28-29-23)6-10-26-24(22)32-19-7-11-31-12-8-19/h2-6,9-10,13-14,19H,7-8,11-12H2,1H3,(H,27,30)(H,28,29)
InChIKeyGAPJEXXXNXCKDE-UHFFFAOYSA-N
XLogP4.20
TPSA102.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.48
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide with MolForge

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Related Compounds

N-methyl-3-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]benzamide
CID 66828941
3-(2-methoxy-4-pyridinyl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine
CID 56942365
(1R,5S)-8-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]-3-oxa-8-azabicyclo[3.2.1]octane
CID 71007922
3-(1H-indazol-5-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine
CID 66826754
2-N-iodo-4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-1-N-(oxolan-3-yl)benzene-1,2-diamine
CID 88578347
N-[3-(4-methyl-2-pyridinyl)phenyl]acetamide
CID 143373898
N-[3-[4-(4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-2-yl)-2-pyridinyl]phenyl]acetamide
CID 59722966
4-[4-[4-(2-methoxyethoxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]morpholine
CID 66829105
3-[3-(3-methoxyphenyl)-1H-pyrazolo[4,3-c]pyridin-4-yl]benzamide
CID 71448678
N-[3-(4-oxo-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)phenyl]acetamide
CID 10214778
N-cyclopropyl-3-[4-(oxan-4-yloxy)-1H-pyrrolo[3,4-c]pyridin-3-yl]benzamide
CID 157369021
N-[3-[2-(hydroxymethyl)-4-pyridinyl]phenyl]acetamide
CID 39773386

Frequently Asked Questions

What is the IUPAC name of N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide?
The IUPAC name of N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide (CID 66829113) is N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide.
What is the SMILES notation for N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide?
The canonical SMILES for N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide is CC(=O)Nc1cccc(-c2cc(-c3n[nH]c4ccnc(OC5CCOCC5)c34)ccn2)c1.
What is the InChIKey of N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide?
The InChIKey is GAPJEXXXNXCKDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O3/c1-15(30)27-18-4-2-3-16(13-18)21-14-17(5-9-25-21)23-22-20(28-29-23)6-10-26-24(22)32-19-7-11-31-12-8-19/h2-6,9-10,13-14,19H,7-8,11-12H2,1H3,(H,27,30)(H,28,29).
What are the key properties of N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide?
N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide has a molecular weight of 429.48 g/mol, XLogP of 4.20, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[4-[4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridin-3-yl]-2-pyridinyl]phenyl]acetamide is sourced from PubChem (CID 66829113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).