7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

C15H22N6 — CID 97467524

IUPAC7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESc1ncn(Cc2cn3c(n2)CN(CC2CCCC2)CC3)n1
InChIInChI=1S/C15H22N6/c1-2-4-13(3-1)7-19-5-6-20-8-14(18-15(20)10-19)9-21-12-16-11-17-21/h8,11-13H,1-7,9-10H2
InChIKeyCBNWJWNILSQOPT-UHFFFAOYSA-N
MW286.38 g/mol
LogP1.53
Rot. Bonds4

About 7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (PubChem CID 97467524) has the molecular formula C15H22N6 and a molecular weight of 286.38 g/mol. Its IUPAC name is 7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
PubChem CID97467524
Molecular FormulaC15H22N6
Molecular Weight286.38 g/mol
Exact Mass286.19
IUPAC Name7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESc1ncn(Cc2cn3c(n2)CN(CC2CCCC2)CC3)n1
InChIInChI=1S/C15H22N6/c1-2-4-13(3-1)7-19-5-6-20-8-14(18-15(20)10-19)9-21-12-16-11-17-21/h8,11-13H,1-7,9-10H2
InChIKeyCBNWJWNILSQOPT-UHFFFAOYSA-N
XLogP1.53
TPSA51.77 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The IUPAC name of 7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (CID 97467524) is 7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.
What is the SMILES notation for 7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The canonical SMILES for 7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is c1ncn(Cc2cn3c(n2)CN(CC2CCCC2)CC3)n1.
What is the InChIKey of 7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The InChIKey is CBNWJWNILSQOPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N6/c1-2-4-13(3-1)7-19-5-6-20-8-14(18-15(20)10-19)9-21-12-16-11-17-21/h8,11-13H,1-7,9-10H2.
What are the key properties of 7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine has a molecular weight of 286.38 g/mol, XLogP of 1.53, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclopentylmethyl)-2-(1,2,4-triazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is sourced from PubChem (CID 97467524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).