N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide

C11H14ClN3O2 — CID 103558724

IUPACN-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide
SMILESCOC1(CC(=O)Nc2nccnc2Cl)CCC1
InChIInChI=1S/C11H14ClN3O2/c1-17-11(3-2-4-11)7-8(16)15-10-9(12)13-5-6-14-10/h5-6H,2-4,7H2,1H3,(H,14,15,16)
InChIKeyJRSANQBFXIKGFF-UHFFFAOYSA-N
MW255.70 g/mol
LogP2.03
Rot. Bonds4

About N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide

N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide (PubChem CID 103558724) has the molecular formula C11H14ClN3O2 and a molecular weight of 255.70 g/mol. Its IUPAC name is N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide.

Molecular Properties

Compound NameN-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide
PubChem CID103558724
Molecular FormulaC11H14ClN3O2
Molecular Weight255.70 g/mol
Exact Mass255.08
IUPAC NameN-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide
SMILESCOC1(CC(=O)Nc2nccnc2Cl)CCC1
InChIInChI=1S/C11H14ClN3O2/c1-17-11(3-2-4-11)7-8(16)15-10-9(12)13-5-6-14-10/h5-6H,2-4,7H2,1H3,(H,14,15,16)
InChIKeyJRSANQBFXIKGFF-UHFFFAOYSA-N
XLogP2.03
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.70
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-3-pyridinyl)-2-(1-methoxycyclobutyl)acetamide
CID 103522047
N-(5-bromo-1,3-thiazol-2-yl)-2-(1-methoxycyclobutyl)acetamide
CID 103556726
N-(5-amino-4-methyl-2-pyridinyl)-2-(1-methoxycyclobutyl)acetamide
CID 103555420
N-(3-chloropyrazin-2-yl)-4-methoxy-3-methylbutanamide
CID 102989723
N-[4-(chloromethyl)-1,3-thiazol-2-yl]-2-(1-methoxycyclobutyl)acetamide
CID 103557096
N-(4-amino-5-chloro-2-methylphenyl)-2-(1-methoxycyclobutyl)acetamide
CID 103555460
2-(1-methoxycyclobutyl)acetohydrazide
CID 103555801
N-(2-acetylphenyl)-2-(1-methoxycyclobutyl)acetamide
CID 103520067
N-(3-chloropyrazin-2-yl)-2-(4-methylphenyl)acetamide
CID 113228993
N-(3-fluoro-4-hydroxyphenyl)-2-(1-methoxycyclobutyl)acetamide
CID 103557015
N-[4-(1-hydroxyethyl)-1,3-thiazol-2-yl]-2-(1-methoxycyclobutyl)acetamide
CID 103557205
N-(3-amino-2,6-dimethylphenyl)-2-(1-methoxycyclobutyl)acetamide
CID 103555368

Frequently Asked Questions

What is the IUPAC name of N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide?
The IUPAC name of N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide (CID 103558724) is N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide.
What is the SMILES notation for N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide?
The canonical SMILES for N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide is COC1(CC(=O)Nc2nccnc2Cl)CCC1.
What is the InChIKey of N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide?
The InChIKey is JRSANQBFXIKGFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3O2/c1-17-11(3-2-4-11)7-8(16)15-10-9(12)13-5-6-14-10/h5-6H,2-4,7H2,1H3,(H,14,15,16).
What are the key properties of N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide?
N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide has a molecular weight of 255.70 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloropyrazin-2-yl)-2-(1-methoxycyclobutyl)acetamide is sourced from PubChem (CID 103558724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).