6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide

C19H21N5O3 — CID 122565079

IUPAC6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide
SMILESNC(=O)CC1CCCCN1C(=O)c1ccc(-c2cncc(C(N)=O)n2)cc1
InChIInChI=1S/C19H21N5O3/c20-17(25)9-14-3-1-2-8-24(14)19(27)13-6-4-12(5-7-13)15-10-22-11-16(23-15)18(21)26/h4-7,10-11,14H,1-3,8-9H2,(H2,20,25)(H2,21,26)
InChIKeyBYFFSYSMVZLGQS-UHFFFAOYSA-N
MW367.41 g/mol
LogP1.11
Rot. Bonds5

About 6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide

6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide (PubChem CID 122565079) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is 6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide
PubChem CID122565079
Molecular FormulaC19H21N5O3
Molecular Weight367.41 g/mol
Exact Mass367.16
IUPAC Name6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide
SMILESNC(=O)CC1CCCCN1C(=O)c1ccc(-c2cncc(C(N)=O)n2)cc1
InChIInChI=1S/C19H21N5O3/c20-17(25)9-14-3-1-2-8-24(14)19(27)13-6-4-12(5-7-13)15-10-22-11-16(23-15)18(21)26/h4-7,10-11,14H,1-3,8-9H2,(H2,20,25)(H2,21,26)
InChIKeyBYFFSYSMVZLGQS-UHFFFAOYSA-N
XLogP1.11
TPSA132.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2S)-1-[4-(3-methyl-4-pyridinyl)benzoyl]piperidin-2-yl]acetamide
CID 126442431
2-[(2S)-1-[4-[4-methyl-6-(methylamino)pyrimidin-2-yl]benzoyl]piperidin-2-yl]acetamide
CID 126442451
2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide
CID 95286122
2-[(2R)-1-(4-pyrrol-1-ylbenzoyl)piperidin-2-yl]acetamide
CID 94818861
2-[(2R)-1-(2,3-dihydro-1H-indene-5-carbonyl)piperidin-2-yl]acetamide
CID 95293673
[2-(hydroxymethyl)piperidin-1-yl]-(4-isoquinolin-4-ylphenyl)methanone
CID 119068023
2-[1-(pyridazine-4-carbonyl)piperidin-2-yl]acetic acid
CID 112640151
2-[(2R)-1-(3-phenyl-2,1-benzoxazole-5-carbonyl)piperidin-2-yl]acetamide
CID 95382927
[4-[(2S)-2-ethylpiperidine-1-carbonyl]phenyl]-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 1087323
2-[(2R)-1-(6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carbonyl)piperidin-2-yl]acetamide
CID 97211737
1-[1-(pyridine-3-carbonyl)piperidin-2-yl]propan-2-one
CID 79548958
2-[1-(6-methylpyridine-3-carbonyl)piperidin-2-yl]acetic acid
CID 54899855

Frequently Asked Questions

What is the IUPAC name of 6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide?
The IUPAC name of 6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide (CID 122565079) is 6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide.
What is the SMILES notation for 6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide?
The canonical SMILES for 6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide is NC(=O)CC1CCCCN1C(=O)c1ccc(-c2cncc(C(N)=O)n2)cc1.
What is the InChIKey of 6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide?
The InChIKey is BYFFSYSMVZLGQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c20-17(25)9-14-3-1-2-8-24(14)19(27)13-6-4-12(5-7-13)15-10-22-11-16(23-15)18(21)26/h4-7,10-11,14H,1-3,8-9H2,(H2,20,25)(H2,21,26).
What are the key properties of 6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide?
6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide has a molecular weight of 367.41 g/mol, XLogP of 1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide is sourced from PubChem (CID 122565079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).