N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide

C21H26N4O — CID 109287538

IUPACN-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
SMILESCC1Cc2ccccc2N1c1cnc(C(=O)NC2CCCCCC2)cn1
InChIInChI=1S/C21H26N4O/c1-15-12-16-8-6-7-11-19(16)25(15)20-14-22-18(13-23-20)21(26)24-17-9-4-2-3-5-10-17/h6-8,11,13-15,17H,2-5,9-10,12H2,1H3,(H,24,26)
InChIKeyQLMXPZKLVKHEFW-UHFFFAOYSA-N
MW350.47 g/mol
LogP4.01
Rot. Bonds3

About N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide

N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide (PubChem CID 109287538) has the molecular formula C21H26N4O and a molecular weight of 350.47 g/mol. Its IUPAC name is N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
PubChem CID109287538
Molecular FormulaC21H26N4O
Molecular Weight350.47 g/mol
Exact Mass350.21
IUPAC NameN-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
SMILESCC1Cc2ccccc2N1c1cnc(C(=O)NC2CCCCCC2)cn1
InChIInChI=1S/C21H26N4O/c1-15-12-16-8-6-7-11-19(16)25(15)20-14-22-18(13-23-20)21(26)24-17-9-4-2-3-5-10-17/h6-8,11,13-15,17H,2-5,9-10,12H2,1H3,(H,24,26)
InChIKeyQLMXPZKLVKHEFW-UHFFFAOYSA-N
XLogP4.01
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.47
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyridazine-3-carboxamide
CID 109125067
N-tert-butyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
CID 109287320
N-cyclopropyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-4-carboxamide
CID 109339394
N-(3-acetamidophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
CID 109294117
N-cyclohexyl-5-(2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
CID 109274719
5-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyrazine-2-carboxamide
CID 109280070
N-(2-methoxyphenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
CID 109293406
5-(2-methyl-2,3-dihydroindol-1-yl)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109292034
N-cycloheptyl-5-(3,4-dihydro-2H-quinolin-1-yl)pyrazine-2-carboxamide
CID 109287476
N-cyclopentyl-5-(2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
CID 109273970
N-(3-acetylphenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
CID 109294041
N-cycloheptyl-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84574692

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide?
The IUPAC name of N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide (CID 109287538) is N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide.
What is the SMILES notation for N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide?
The canonical SMILES for N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide is CC1Cc2ccccc2N1c1cnc(C(=O)NC2CCCCCC2)cn1.
What is the InChIKey of N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide?
The InChIKey is QLMXPZKLVKHEFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O/c1-15-12-16-8-6-7-11-19(16)25(15)20-14-22-18(13-23-20)21(26)24-17-9-4-2-3-5-10-17/h6-8,11,13-15,17H,2-5,9-10,12H2,1H3,(H,24,26).
What are the key properties of N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide?
N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide has a molecular weight of 350.47 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 109287538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).