N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide

C19H22N6O4 — CID 42866695

IUPACN-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide
SMILESCOCC(=O)N1CCC(NC(=O)c2nccnc2NC(=O)c2ccccn2)CC1
InChIInChI=1S/C19H22N6O4/c1-29-12-15(26)25-10-5-13(6-11-25)23-19(28)16-17(22-9-8-21-16)24-18(27)14-4-2-3-7-20-14/h2-4,7-9,13H,5-6,10-12H2,1H3,(H,23,28)(H,22,24,27)
InChIKeyUGEVIMKLUIEMMT-UHFFFAOYSA-N
MW398.42 g/mol
LogP0.49
Rot. Bonds6

About N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide

N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide (PubChem CID 42866695) has the molecular formula C19H22N6O4 and a molecular weight of 398.42 g/mol. Its IUPAC name is N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide
PubChem CID42866695
Molecular FormulaC19H22N6O4
Molecular Weight398.42 g/mol
Exact Mass398.17
IUPAC NameN-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide
SMILESCOCC(=O)N1CCC(NC(=O)c2nccnc2NC(=O)c2ccccn2)CC1
InChIInChI=1S/C19H22N6O4/c1-29-12-15(26)25-10-5-13(6-11-25)23-19(28)16-17(22-9-8-21-16)24-18(27)14-4-2-3-7-20-14/h2-4,7-9,13H,5-6,10-12H2,1H3,(H,23,28)(H,22,24,27)
InChIKeyUGEVIMKLUIEMMT-UHFFFAOYSA-N
XLogP0.49
TPSA126.41 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.42
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-benzamido-N-(1-propanoylpiperidin-4-yl)pyrazine-2-carboxamide
CID 83281431
N-[1-[2-(2,3-dimethylphenoxy)acetyl]piperidin-4-yl]pyridine-2-carboxamide
CID 108557840
3-[(4-methylbenzoyl)amino]-N-[1-(2-phenylacetyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 42853891
3-benzamido-N-(1-benzoylpiperidin-4-yl)pyrazine-2-carboxamide
CID 90488210
N-[1-[2-(4-propylphenoxy)acetyl]piperidin-4-yl]pyridine-2-carboxamide
CID 108557843
ethyl 4-oxo-4-[4-(pyridine-2-carbonylamino)piperidin-1-yl]butanoate
CID 108562777
prop-2-enyl 4-(pyridine-2-carbonylamino)piperidine-1-carboxylate
CID 108562791
N-(1-benzylpiperidin-4-yl)-3-[(4-methoxybenzoyl)amino]pyrazine-2-carboxamide
CID 42866621
N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-sulfanylbenzamide
CID 108554750
3-[(3-methylbenzoyl)amino]-N-[1-(3-methylbutanoyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 46049142
methyl 4-[[3-(2,2-dimethylpropanoylamino)pyrazine-2-carbonyl]amino]piperidine-1-carboxylate
CID 42853977
N-[1-[4-(4-methylphenoxy)butanoyl]piperidin-4-yl]pyridine-2-carboxamide
CID 108557848

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide?
The IUPAC name of N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide (CID 42866695) is N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide is COCC(=O)N1CCC(NC(=O)c2nccnc2NC(=O)c2ccccn2)CC1.
What is the InChIKey of N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide?
The InChIKey is UGEVIMKLUIEMMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O4/c1-29-12-15(26)25-10-5-13(6-11-25)23-19(28)16-17(22-9-8-21-16)24-18(27)14-4-2-3-7-20-14/h2-4,7-9,13H,5-6,10-12H2,1H3,(H,23,28)(H,22,24,27).
What are the key properties of N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide?
N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide has a molecular weight of 398.42 g/mol, XLogP of 0.49, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 42866695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).