N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide

C20H37N3OSn — CID 67455068

IUPACN-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide
SMILESCCCC[Sn](CCCC)(CCCC)c1cncc(C(=O)N(C)CC)n1
InChIInChI=1S/C8H10N3O.3C4H9.Sn/c1-3-11(2)8(12)7-6-9-4-5-10-7;3*1-3-4-2;/h4,6H,3H2,1-2H3;3*1,3-4H2,2H3;
InChIKeyDIEBBOHDGNKQAL-UHFFFAOYSA-N
MW454.25 g/mol
LogP4.62
Rot. Bonds12

About N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide

N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide (PubChem CID 67455068) has the molecular formula C20H37N3OSn and a molecular weight of 454.25 g/mol. Its IUPAC name is N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide
PubChem CID67455068
Molecular FormulaC20H37N3OSn
Molecular Weight454.25 g/mol
Exact Mass455.20
IUPAC NameN-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide
SMILESCCCC[Sn](CCCC)(CCCC)c1cncc(C(=O)N(C)CC)n1
InChIInChI=1S/C8H10N3O.3C4H9.Sn/c1-3-11(2)8(12)7-6-9-4-5-10-7;3*1-3-4-2;/h4,6H,3H2,1-2H3;3*1,3-4H2,2H3;
InChIKeyDIEBBOHDGNKQAL-UHFFFAOYSA-N
XLogP4.62
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.25
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-N-methyl-N-prop-2-ynylpyrazine-2-carboxamide
CID 106551756
5-chloro-N-ethyl-N-methylpyridine-2-carboxamide
CID 126994087
6-chloro-N,N-dipropylpyrazine-2-carboxamide
CID 103186958
6-chloro-N-methyl-N-(3-methylbutyl)pyrazine-2-carboxamide
CID 106551043
2-N,6-N-bis(2,3-dihydroxypropyl)-2-N,6-N-dimethylpyrazine-2,6-dicarboxamide
CID 22457886
N-(2-amino-2-oxoethyl)-N-butyl-6-chloropyrazine-2-carboxamide
CID 106551596
6-chloro-N-[2-(dimethylamino)ethyl]-N-propylpyrazine-2-carboxamide
CID 106551556
tributyl-(6-tributylstannylpyrimidin-4-yl)stannane
CID 86280249
6-amino-N-[3-(dimethylamino)propyl]-N-ethylpyrazine-2-carboxamide
CID 114036119
CID 59369483
CID 59369483
CID 59369515
CID 59369515
N-butyl-5-chloro-N-methylpyrazine-2-carboxamide
CID 103803325

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide?
The IUPAC name of N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide (CID 67455068) is N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide.
What is the SMILES notation for N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide?
The canonical SMILES for N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide is CCCC[Sn](CCCC)(CCCC)c1cncc(C(=O)N(C)CC)n1.
What is the InChIKey of N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide?
The InChIKey is DIEBBOHDGNKQAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N3O.3C4H9.Sn/c1-3-11(2)8(12)7-6-9-4-5-10-7;3*1-3-4-2;/h4,6H,3H2,1-2H3;3*1,3-4H2,2H3;.
What are the key properties of N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide?
N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide has a molecular weight of 454.25 g/mol, XLogP of 4.62, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-6-tributylstannylpyrazine-2-carboxamide is sourced from PubChem (CID 67455068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).