N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine

C14H18N4 — CID 78988709

IUPACN-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine
SMILESc1cnc2nc(NCC3CCCCC3)ccc2n1
InChIInChI=1S/C14H18N4/c1-2-4-11(5-3-1)10-17-13-7-6-12-14(18-13)16-9-8-15-12/h6-9,11H,1-5,10H2,(H,16,17,18)
InChIKeyCJKZYJAFOVDFDQ-UHFFFAOYSA-N
MW242.33 g/mol
LogP3.02
Rot. Bonds3

About N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine

N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine (PubChem CID 78988709) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine.

Molecular Properties

Compound NameN-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine
PubChem CID78988709
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC NameN-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine
SMILESc1cnc2nc(NCC3CCCCC3)ccc2n1
InChIInChI=1S/C14H18N4/c1-2-4-11(5-3-1)10-17-13-7-6-12-14(18-13)16-9-8-15-12/h6-9,11H,1-5,10H2,(H,16,17,18)
InChIKeyCJKZYJAFOVDFDQ-UHFFFAOYSA-N
XLogP3.02
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine?
The IUPAC name of N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine (CID 78988709) is N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine.
What is the SMILES notation for N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine?
The canonical SMILES for N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine is c1cnc2nc(NCC3CCCCC3)ccc2n1.
What is the InChIKey of N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine?
The InChIKey is CJKZYJAFOVDFDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-2-4-11(5-3-1)10-17-13-7-6-12-14(18-13)16-9-8-15-12/h6-9,11H,1-5,10H2,(H,16,17,18).
What are the key properties of N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine?
N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine has a molecular weight of 242.33 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)pyrido[2,3-b]pyrazin-6-amine is sourced from PubChem (CID 78988709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).