N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide

C19H18ClN5O — CID 175651012

IUPACN-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide
SMILESO=C(NC1CCCN(c2cnc3cc(Cl)ccc3n2)C1)c1cccnc1
InChIInChI=1S/C19H18ClN5O/c20-14-5-6-16-17(9-14)22-11-18(24-16)25-8-2-4-15(12-25)23-19(26)13-3-1-7-21-10-13/h1,3,5-7,9-11,15H,2,4,8,12H2,(H,23,26)
InChIKeyXYGDFAZAFJUPDZ-UHFFFAOYSA-N
MW367.84 g/mol
LogP3.08
Rot. Bonds3

About N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide

N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide (PubChem CID 175651012) has the molecular formula C19H18ClN5O and a molecular weight of 367.84 g/mol. Its IUPAC name is N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide
PubChem CID175651012
Molecular FormulaC19H18ClN5O
Molecular Weight367.84 g/mol
Exact Mass367.12
IUPAC NameN-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide
SMILESO=C(NC1CCCN(c2cnc3cc(Cl)ccc3n2)C1)c1cccnc1
InChIInChI=1S/C19H18ClN5O/c20-14-5-6-16-17(9-14)22-11-18(24-16)25-8-2-4-15(12-25)23-19(26)13-3-1-7-21-10-13/h1,3,5-7,9-11,15H,2,4,8,12H2,(H,23,26)
InChIKeyXYGDFAZAFJUPDZ-UHFFFAOYSA-N
XLogP3.08
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.84
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyrimidine-4-carboxamide
CID 175650980
N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]-1,5-dimethylpyrazole-3-carboxamide
CID 172903697
N-[1-[7-(trifluoromethyl)quinolin-4-yl]piperidin-3-yl]pyridine-3-carboxamide
CID 175651784
N-[1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidin-3-yl]pyridine-3-carboxamide
CID 175651185
2-N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]-4-N,4-N-dimethylpyrimidine-2,4-diamine
CID 171999798
N-cyclopentylpyridine-3-carboxamide
CID 805532
N-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]pyridine-3-carboxamide
CID 175648718
N-(1-quinoxalin-2-ylpiperidin-3-yl)cyclopropanecarboxamide
CID 155975943
6-chloro-2-piperidin-1-ylquinoxaline
CID 171705162
N-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-4-pyrrolidin-1-ylbenzamide
CID 99990589
N-(1-quinoxalin-2-ylpiperidin-4-yl)benzamide
CID 33378138
N-[(3R)-1-(2,4-difluorophenyl)pyrrolidin-3-yl]pyridine-3-carboxamide
CID 95614562

Frequently Asked Questions

What is the IUPAC name of N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide?
The IUPAC name of N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide (CID 175651012) is N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide is O=C(NC1CCCN(c2cnc3cc(Cl)ccc3n2)C1)c1cccnc1.
What is the InChIKey of N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide?
The InChIKey is XYGDFAZAFJUPDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN5O/c20-14-5-6-16-17(9-14)22-11-18(24-16)25-8-2-4-15(12-25)23-19(26)13-3-1-7-21-10-13/h1,3,5-7,9-11,15H,2,4,8,12H2,(H,23,26).
What are the key properties of N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide?
N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide has a molecular weight of 367.84 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-chloroquinoxalin-2-yl)piperidin-3-yl]pyridine-3-carboxamide is sourced from PubChem (CID 175651012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).