N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide

C18H20N6O2 — CID 167983413

IUPACN-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide
SMILESCn1ccnc(N2CCCC(NC(=O)c3n[nH]c4ccccc34)C2)c1=O
InChIInChI=1S/C18H20N6O2/c1-23-10-8-19-16(18(23)26)24-9-4-5-12(11-24)20-17(25)15-13-6-2-3-7-14(13)21-22-15/h2-3,6-8,10,12H,4-5,9,11H2,1H3,(H,20,25)(H,21,22)
InChIKeyMDSLWRMKKMDFNQ-UHFFFAOYSA-N
MW352.40 g/mol
LogP1.06
Rot. Bonds3

About N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide

N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide (PubChem CID 167983413) has the molecular formula C18H20N6O2 and a molecular weight of 352.40 g/mol. Its IUPAC name is N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide
PubChem CID167983413
Molecular FormulaC18H20N6O2
Molecular Weight352.40 g/mol
Exact Mass352.16
IUPAC NameN-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide
SMILESCn1ccnc(N2CCCC(NC(=O)c3n[nH]c4ccccc34)C2)c1=O
InChIInChI=1S/C18H20N6O2/c1-23-10-8-19-16(18(23)26)24-9-4-5-12(11-24)20-17(25)15-13-6-2-3-7-14(13)21-22-15/h2-3,6-8,10,12H,4-5,9,11H2,1H3,(H,20,25)(H,21,22)
InChIKeyMDSLWRMKKMDFNQ-UHFFFAOYSA-N
XLogP1.06
TPSA95.91 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.40
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-(2-oxo-1H-pyrazin-3-yl)piperidin-3-yl]-1H-indazole-3-carboxamide
CID 167764107
N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-5-carboxamide
CID 128989356
2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide
CID 129475393
N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 128989377
1-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-3-pyridin-4-ylurea
CID 128965407
N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-2,3-dihydro-1H-indene-5-carboxamide
CID 154737044
N-[(3S)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-2,3-dihydro-1H-indene-4-carboxamide
CID 129336990
N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1,3-thiazole-4-carboxamide
CID 128967028
N-[(3S)-1-(2-chloropyrimidin-4-yl)pyrrolidin-3-yl]-1H-indazole-3-carboxamide
CID 166320138
3-[(3S)-3-(2,3-dihydro-1H-inden-2-ylamino)piperidin-1-yl]-1-methylpyrazin-2-one
CID 129475497
N-(1-acetylpiperidin-4-yl)-1H-indazole-3-carboxamide
CID 10108057
tert-butyl N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]carbamate
CID 99817733

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide (CID 167983413) is N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide is Cn1ccnc(N2CCCC(NC(=O)c3n[nH]c4ccccc34)C2)c1=O.
What is the InChIKey of N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide?
The InChIKey is MDSLWRMKKMDFNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O2/c1-23-10-8-19-16(18(23)26)24-9-4-5-12(11-24)20-17(25)15-13-6-2-3-7-14(13)21-22-15/h2-3,6-8,10,12H,4-5,9,11H2,1H3,(H,20,25)(H,21,22).
What are the key properties of N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide?
N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide has a molecular weight of 352.40 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 167983413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).