N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide

C18H28N4O — CID 109274884

IUPACN-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide
SMILESO=C(NC1CCCCCC1)c1cnc(NC2CCCCC2)cn1
InChIInChI=1S/C18H28N4O/c23-18(22-15-10-4-1-2-5-11-15)16-12-20-17(13-19-16)21-14-8-6-3-7-9-14/h12-15H,1-11H2,(H,20,21)(H,22,23)
InChIKeyADGNILTWSNUBQV-UHFFFAOYSA-N
MW316.45 g/mol
LogP3.67
Rot. Bonds4

About N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide

N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide (PubChem CID 109274884) has the molecular formula C18H28N4O and a molecular weight of 316.45 g/mol. Its IUPAC name is N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide
PubChem CID109274884
Molecular FormulaC18H28N4O
Molecular Weight316.45 g/mol
Exact Mass316.23
IUPAC NameN-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide
SMILESO=C(NC1CCCCCC1)c1cnc(NC2CCCCC2)cn1
InChIInChI=1S/C18H28N4O/c23-18(22-15-10-4-1-2-5-11-15)16-12-20-17(13-19-16)21-14-8-6-3-7-9-14/h12-15H,1-11H2,(H,20,21)(H,22,23)
InChIKeyADGNILTWSNUBQV-UHFFFAOYSA-N
XLogP3.67
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.45
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-5-(cyclohexylamino)pyrazine-2-carboxamide
CID 109274635
5-(cyclooctylcarbamoyl)pyrazine-2-carboxylic acid
CID 120684742
N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide
CID 109271032
N-cyclobutyl-5-(methylamino)pyrazine-2-carboxamide
CID 107375423
5-amino-N-cyclooctylpyrazine-2-carboxamide
CID 113381836
5-(cycloheptylamino)-N-(2-methylpropyl)pyrazine-2-carboxamide
CID 109272801
N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide
CID 109273887
N-(4-acetamidophenyl)-5-(cyclopentylamino)pyrazine-2-carboxamide
CID 109274209
6-(cyclohexylamino)-N-cyclopropylpyridine-3-carboxamide
CID 25473351
N-cyclohexyl-6-(cyclohexylamino)pyrimidine-4-carboxamide
CID 109341807
N-cyclohexyl-6-(cyclohexylamino)pyridazine-3-carboxamide
CID 109112809
5-(cyclopentylamino)-N-(3,5-dimethylphenyl)pyrazine-2-carboxamide
CID 109274163

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide?
The IUPAC name of N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide (CID 109274884) is N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide is O=C(NC1CCCCCC1)c1cnc(NC2CCCCC2)cn1.
What is the InChIKey of N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide?
The InChIKey is ADGNILTWSNUBQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4O/c23-18(22-15-10-4-1-2-5-11-15)16-12-20-17(13-19-16)21-14-8-6-3-7-9-14/h12-15H,1-11H2,(H,20,21)(H,22,23).
What are the key properties of N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide?
N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide has a molecular weight of 316.45 g/mol, XLogP of 3.67, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 109274884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).