N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine

C14H19N5 — CID 174673902

IUPACN-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine
SMILESc1cn(-c2cncc(NCC3CCCCC3)n2)cn1
InChIInChI=1S/C14H19N5/c1-2-4-12(5-3-1)8-17-13-9-16-10-14(18-13)19-7-6-15-11-19/h6-7,9-12H,1-5,8H2,(H,17,18)
InChIKeyRKCQDQFINZOGQT-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.65
Rot. Bonds4

About N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine

N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine (PubChem CID 174673902) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine
PubChem CID174673902
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC NameN-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine
SMILESc1cn(-c2cncc(NCC3CCCCC3)n2)cn1
InChIInChI=1S/C14H19N5/c1-2-4-12(5-3-1)8-17-13-9-16-10-14(18-13)19-7-6-15-11-19/h6-7,9-12H,1-5,8H2,(H,17,18)
InChIKeyRKCQDQFINZOGQT-UHFFFAOYSA-N
XLogP2.65
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine?
The IUPAC name of N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine (CID 174673902) is N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine.
What is the SMILES notation for N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine?
The canonical SMILES for N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine is c1cn(-c2cncc(NCC3CCCCC3)n2)cn1.
What is the InChIKey of N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine?
The InChIKey is RKCQDQFINZOGQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-2-4-12(5-3-1)8-17-13-9-16-10-14(18-13)19-7-6-15-11-19/h6-7,9-12H,1-5,8H2,(H,17,18).
What are the key properties of N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine?
N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine has a molecular weight of 257.34 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-6-imidazol-1-ylpyrazin-2-amine is sourced from PubChem (CID 174673902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).