N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride

C8H10Cl2N4O — CID 118279228

IUPACN-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride
SMILESCl.O=C(NC1CNC1)c1cncc(Cl)n1
InChIInChI=1S/C8H9ClN4O.ClH/c9-7-4-11-3-6(13-7)8(14)12-5-1-10-2-5;/h3-5,10H,1-2H2,(H,12,14);1H
InChIKeySRMZDXNJOKZDSE-UHFFFAOYSA-N
MW249.10 g/mol
LogP0.25
Rot. Bonds2

About N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride

N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride (PubChem CID 118279228) has the molecular formula C8H10Cl2N4O and a molecular weight of 249.10 g/mol. Its IUPAC name is N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride
PubChem CID118279228
Molecular FormulaC8H10Cl2N4O
Molecular Weight249.10 g/mol
Exact Mass248.02
IUPAC NameN-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride
SMILESCl.O=C(NC1CNC1)c1cncc(Cl)n1
InChIInChI=1S/C8H9ClN4O.ClH/c9-7-4-11-3-6(13-7)8(14)12-5-1-10-2-5;/h3-5,10H,1-2H2,(H,12,14);1H
InChIKeySRMZDXNJOKZDSE-UHFFFAOYSA-N
XLogP0.25
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.10
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(6-chloropyrazine-2-carbonyl)amino]azetidine-1-carboxylic acid
CID 118279389
6-chloro-N-(4-hydroxycyclohexyl)pyrazine-2-carboxamide
CID 103336797
6-chloro-N-(thian-4-yl)pyrazine-2-carboxamide
CID 106551266
cis-(1R,3S)-3-[(6-chloropyrazine-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 106321292
6-chloro-N-(1-methylpiperidin-3-yl)pyrazine-2-carboxamide
CID 106551204
6-chloro-N-(2-methyloxan-4-yl)pyrazine-2-carboxamide
CID 106551626
6-chloro-N-[1-(2-methoxyacetyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 106551335
6-chloro-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]pyrazine-2-carboxamide
CID 106551559
N-(azetidin-3-yl)-2-methyltriazole-4-carboxamide
CID 126978139
(6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride
CID 118279345
6-chloro-N-[2-(cyclopropylmethoxy)ethyl]pyrazine-2-carboxamide
CID 106551316
6-chloro-N-[2-[cyclopropyl(methyl)amino]ethyl]pyrazine-2-carboxamide
CID 106551219

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride?
The IUPAC name of N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride (CID 118279228) is N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride is Cl.O=C(NC1CNC1)c1cncc(Cl)n1.
What is the InChIKey of N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride?
The InChIKey is SRMZDXNJOKZDSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN4O.ClH/c9-7-4-11-3-6(13-7)8(14)12-5-1-10-2-5;/h3-5,10H,1-2H2,(H,12,14);1H.
What are the key properties of N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride?
N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride has a molecular weight of 249.10 g/mol, XLogP of 0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-6-chloropyrazine-2-carboxamide;hydrochloride is sourced from PubChem (CID 118279228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).