N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide

C20H24N6O — CID 130366569

IUPACN-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide
SMILESCC(=O)Nc1cnn(C2CCN(C(C)c3ccc4nccnc4c3)CC2)c1
InChIInChI=1S/C20H24N6O/c1-14(16-3-4-19-20(11-16)22-8-7-21-19)25-9-5-18(6-10-25)26-13-17(12-23-26)24-15(2)27/h3-4,7-8,11-14,18H,5-6,9-10H2,1-2H3,(H,24,27)
InChIKeyGKQIIKHRWQFGON-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.18
Rot. Bonds4

About N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide

N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide (PubChem CID 130366569) has the molecular formula C20H24N6O and a molecular weight of 364.45 g/mol. Its IUPAC name is N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide.

Molecular Properties

Compound NameN-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide
PubChem CID130366569
Molecular FormulaC20H24N6O
Molecular Weight364.45 g/mol
Exact Mass364.20
IUPAC NameN-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide
SMILESCC(=O)Nc1cnn(C2CCN(C(C)c3ccc4nccnc4c3)CC2)c1
InChIInChI=1S/C20H24N6O/c1-14(16-3-4-19-20(11-16)22-8-7-21-19)25-9-5-18(6-10-25)26-13-17(12-23-26)24-15(2)27/h3-4,7-8,11-14,18H,5-6,9-10H2,1-2H3,(H,24,27)
InChIKeyGKQIIKHRWQFGON-UHFFFAOYSA-N
XLogP3.18
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-4-pyridin-4-yltriazol-1-yl)acetamide
CID 134141860
1-[4-[[2-[(1-Methylpyrazol-4-yl)amino]quinazolin-8-yl]amino]piperidin-1-yl]ethanone
CID 162423118
Chmfl-btk-11
CID 126970680
7-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-N-(2-phenyl-4-pyridinyl)quinolin-4-amine
CID 164628562
N-(3-quinoxalin-2-ylphenyl)acetamide
CID 650863
N-(3-quinoxalin-2-ylphenyl)propanamide
CID 952076
N-[4-(2-acetyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-5-yl)phenyl]methanesulfonamide
CID 2963427
N-(4-(2-(pyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl)acetamide
CID 9969336
2-(dimethylamino)-N-(4-(2-(pyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl)acetamide
CID 10179913
N-(4-(4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)pyridin-2-yl)phenyl)-2-(pyrrolidin-1-yl)acetamide
CID 10273926
N-(3-Cyanophenyl)-2-(3-(6-methylpyridin-2-yl)-4-(quinolin-6-yl)-1H-pyrazol-1-yl)acetamide
CID 52920793
1-[7-(1-Methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-3-phenylurea
CID 53236671

Frequently Asked Questions

What is the IUPAC name of N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide?
The IUPAC name of N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide (CID 130366569) is N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide.
What is the SMILES notation for N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide?
The canonical SMILES for N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide is CC(=O)Nc1cnn(C2CCN(C(C)c3ccc4nccnc4c3)CC2)c1.
What is the InChIKey of N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide?
The InChIKey is GKQIIKHRWQFGON-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O/c1-14(16-3-4-19-20(11-16)22-8-7-21-19)25-9-5-18(6-10-25)26-13-17(12-23-26)24-15(2)27/h3-4,7-8,11-14,18H,5-6,9-10H2,1-2H3,(H,24,27).
What are the key properties of N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide?
N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide has a molecular weight of 364.45 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[1-(1-quinoxalin-6-ylethyl)piperidin-4-yl]pyrazol-4-yl]acetamide is sourced from PubChem (CID 130366569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).