N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide

C12H12BrN5O — CID 104641632

IUPACN-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)Nc2cnc(Br)cn2)nc1
InChIInChI=1S/C12H12BrN5O/c1-2-14-8-3-4-9(15-5-8)12(19)18-11-7-16-10(13)6-17-11/h3-7,14H,2H2,1H3,(H,17,18,19)
InChIKeyCXVMNIGPFHOWTN-UHFFFAOYSA-N
MW322.17 g/mol
LogP2.32
Rot. Bonds4

About N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide

N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide (PubChem CID 104641632) has the molecular formula C12H12BrN5O and a molecular weight of 322.17 g/mol. Its IUPAC name is N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide
PubChem CID104641632
Molecular FormulaC12H12BrN5O
Molecular Weight322.17 g/mol
Exact Mass321.02
IUPAC NameN-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)Nc2cnc(Br)cn2)nc1
InChIInChI=1S/C12H12BrN5O/c1-2-14-8-3-4-9(15-5-8)12(19)18-11-7-16-10(13)6-17-11/h3-7,14H,2H2,1H3,(H,17,18,19)
InChIKeyCXVMNIGPFHOWTN-UHFFFAOYSA-N
XLogP2.32
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.17
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-bromopyrazin-2-yl)-5-(propylamino)pyridine-2-carboxamide
CID 104641633
N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104640067
5-amino-N-(5-bromopyrazin-2-yl)pyridine-2-carboxamide
CID 81316335
5-(ethylamino)-N-methylpyridine-2-carboxamide
CID 104639889
N-(3-bromo-4-chlorophenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104641780
N-(5-bromopyrazin-2-yl)-5-methylpyrazine-2-carboxamide
CID 115650022
N-(5-bromopyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 115692921
N-(2-bromo-4-fluorophenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104640072
N-(3-bromo-4-methoxyphenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104641623
N-[(4-bromophenyl)methyl]-5-(ethylamino)pyridine-2-carboxamide
CID 104639845
5-(ethylamino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 104640059
6-bromo-N-ethylpyridin-3-amine;hydrochloride
CID 87426556

Frequently Asked Questions

What is the IUPAC name of N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide?
The IUPAC name of N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide (CID 104641632) is N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide is CCNc1ccc(C(=O)Nc2cnc(Br)cn2)nc1.
What is the InChIKey of N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide?
The InChIKey is CXVMNIGPFHOWTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12BrN5O/c1-2-14-8-3-4-9(15-5-8)12(19)18-11-7-16-10(13)6-17-11/h3-7,14H,2H2,1H3,(H,17,18,19).
What are the key properties of N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide?
N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide has a molecular weight of 322.17 g/mol, XLogP of 2.32, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromopyrazin-2-yl)-5-(ethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 104641632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).