N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen

C18H23N5O2 — CID 160655859

IUPACN-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen
SMILESCc1ncc(-c2cccnc2)nc1C(=O)Nc1cccc(C(N)=O)c1.[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C18H15N5O2.4H2/c1-11-16(23-15(10-21-11)13-5-3-7-20-9-13)18(25)22-14-6-2-4-12(8-14)17(19)24;;;;/h2-10H,1H3,(H2,19,24)(H,22,25);4*1H
InChIKeyRLAQALRHWAQNCD-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.18
Rot. Bonds4

About N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen

N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen (PubChem CID 160655859) has the molecular formula C18H23N5O2 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen.

Molecular Properties

Compound NameN-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen
PubChem CID160655859
Molecular FormulaC18H23N5O2
Molecular Weight341.41 g/mol
Exact Mass341.19
IUPAC NameN-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen
SMILESCc1ncc(-c2cccnc2)nc1C(=O)Nc1cccc(C(N)=O)c1.[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C18H15N5O2.4H2/c1-11-16(23-15(10-21-11)13-5-3-7-20-9-13)18(25)22-14-6-2-4-12(8-14)17(19)24;;;;/h2-10H,1H3,(H2,19,24)(H,22,25);4*1H
InChIKeyRLAQALRHWAQNCD-UHFFFAOYSA-N
XLogP3.18
TPSA110.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-acetamido-2-methoxyphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen
CID 157383195
6-(3-aminophenyl)-3-methyl-N-phenylpyrazine-2-carboxamide
CID 160820258
CID 59472039
CID 59472039
3-methyl-6-[3-(4-methylpiperazine-1-carbonyl)phenyl]-N-phenylpyrazine-2-carboxamide
CID 158922559
N-(3-pyridin-3-ylphenyl)pyridine-3-carboxamide
CID 110461666
3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]benzamide
CID 58791547
3-pyridin-3-ylbenzamide;hydrochloride
CID 175813431
3-amino-N-(1-methylindol-6-yl)-6-pyridin-3-ylpyrazine-2-carboxamide
CID 130206369
3-amino-N-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen
CID 159900740
3-amino-N-(1H-indol-6-yl)-6-pyridin-3-ylpyrazine-2-carboxamide
CID 59471623
3-amino-N-(1H-indol-5-yl)-6-pyridin-3-ylpyrazine-2-carboxamide
CID 46834031
3-[[3-(pyridin-3-ylcarbamoyl)phenyl]carbamoyl]pyrazine-2-carboxylic acid
CID 56763143

Frequently Asked Questions

What is the IUPAC name of N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen?
The IUPAC name of N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen (CID 160655859) is N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen.
What is the SMILES notation for N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen?
The canonical SMILES for N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen is Cc1ncc(-c2cccnc2)nc1C(=O)Nc1cccc(C(N)=O)c1.[H][H].[H][H].[H][H].[H][H].
What is the InChIKey of N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen?
The InChIKey is RLAQALRHWAQNCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O2.4H2/c1-11-16(23-15(10-21-11)13-5-3-7-20-9-13)18(25)22-14-6-2-4-12(8-14)17(19)24;;;;/h2-10H,1H3,(H2,19,24)(H,22,25);4*1H.
What are the key properties of N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen?
N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen has a molecular weight of 341.41 g/mol, XLogP of 3.18, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-carbamoylphenyl)-3-methyl-6-pyridin-3-ylpyrazine-2-carboxamide;molecular hydrogen is sourced from PubChem (CID 160655859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).