5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide

C17H21N5O — CID 109274849

IUPAC5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide
SMILESO=C(NCc1ccncc1)c1cnc(NC2CCCCC2)cn1
InChIInChI=1S/C17H21N5O/c23-17(21-10-13-6-8-18-9-7-13)15-11-20-16(12-19-15)22-14-4-2-1-3-5-14/h6-9,11-12,14H,1-5,10H2,(H,20,22)(H,21,23)
InChIKeyZEWSLECIBZFSOM-UHFFFAOYSA-N
MW311.39 g/mol
LogP2.55
Rot. Bonds5

About 5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide

5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide (PubChem CID 109274849) has the molecular formula C17H21N5O and a molecular weight of 311.39 g/mol. Its IUPAC name is 5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide
PubChem CID109274849
Molecular FormulaC17H21N5O
Molecular Weight311.39 g/mol
Exact Mass311.17
IUPAC Name5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide
SMILESO=C(NCc1ccncc1)c1cnc(NC2CCCCC2)cn1
InChIInChI=1S/C17H21N5O/c23-17(21-10-13-6-8-18-9-7-13)15-11-20-16(12-19-15)22-14-4-2-1-3-5-14/h6-9,11-12,14H,1-5,10H2,(H,20,22)(H,21,23)
InChIKeyZEWSLECIBZFSOM-UHFFFAOYSA-N
XLogP2.55
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(cyclopropylamino)-N-[(4-methylphenyl)methyl]pyrazine-2-carboxamide
CID 109271773
6-(cyclopentylamino)-N-(pyridin-4-ylmethyl)pyridazine-3-carboxamide
CID 109112110
5-(cycloheptylamino)-N-[(2-methylphenyl)methyl]pyrazine-2-carboxamide
CID 109279992
5-(cycloheptylamino)-N-(2-methylpropyl)pyrazine-2-carboxamide
CID 109272801
N-cyclohexyl-5-(cyclohexylamino)pyrazine-2-carboxamide
CID 109274635
N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide
CID 109274884
6-(cyclopentylamino)-2-phenyl-N-(pyridin-4-ylmethyl)pyrimidine-4-carboxamide
CID 112852815
5-(azepan-1-yl)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide
CID 109283539
5-(butylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide
CID 109272569
N-(pyridin-4-ylmethyl)-5-(4-pyrrolidin-1-ylanilino)pyrazine-2-carboxamide
CID 109283603
5-[(1,1-dioxothiolan-3-yl)amino]-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide
CID 109283221
5-(cyclopropylamino)-N-[(2-methylphenyl)methyl]pyrazine-2-carboxamide
CID 109271771

Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide (CID 109274849) is 5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide is O=C(NCc1ccncc1)c1cnc(NC2CCCCC2)cn1.
What is the InChIKey of 5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide?
The InChIKey is ZEWSLECIBZFSOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O/c23-17(21-10-13-6-8-18-9-7-13)15-11-20-16(12-19-15)22-14-4-2-1-3-5-14/h6-9,11-12,14H,1-5,10H2,(H,20,22)(H,21,23).
What are the key properties of 5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide?
5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide has a molecular weight of 311.39 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109274849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).