7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one

C18H26N4O — CID 72909219

IUPAC7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one
SMILESCc1ncc(N2CCC3(CCCN(CC4CC4)C3=O)C2)nc1C
InChIInChI=1S/C18H26N4O/c1-13-14(2)20-16(10-19-13)22-9-7-18(12-22)6-3-8-21(17(18)23)11-15-4-5-15/h10,15H,3-9,11-12H2,1-2H3
InChIKeyKFLOZCWSTYNIOI-UHFFFAOYSA-N
MW314.43 g/mol
LogP2.32
Rot. Bonds3

About 7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one

7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one (PubChem CID 72909219) has the molecular formula C18H26N4O and a molecular weight of 314.43 g/mol. Its IUPAC name is 7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one.

Molecular Properties

Compound Name7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one
PubChem CID72909219
Molecular FormulaC18H26N4O
Molecular Weight314.43 g/mol
Exact Mass314.21
IUPAC Name7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one
SMILESCc1ncc(N2CCC3(CCCN(CC4CC4)C3=O)C2)nc1C
InChIInChI=1S/C18H26N4O/c1-13-14(2)20-16(10-19-13)22-9-7-18(12-22)6-3-8-21(17(18)23)11-15-4-5-15/h10,15H,3-9,11-12H2,1-2H3
InChIKeyKFLOZCWSTYNIOI-UHFFFAOYSA-N
XLogP2.32
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one?
The IUPAC name of 7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one (CID 72909219) is 7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one.
What is the SMILES notation for 7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one?
The canonical SMILES for 7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one is Cc1ncc(N2CCC3(CCCN(CC4CC4)C3=O)C2)nc1C.
What is the InChIKey of 7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one?
The InChIKey is KFLOZCWSTYNIOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O/c1-13-14(2)20-16(10-19-13)22-9-7-18(12-22)6-3-8-21(17(18)23)11-15-4-5-15/h10,15H,3-9,11-12H2,1-2H3.
What are the key properties of 7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one?
7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one has a molecular weight of 314.43 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclopropylmethyl)-2-(5,6-dimethylpyrazin-2-yl)-2,7-diazaspiro[4.5]decan-6-one is sourced from PubChem (CID 72909219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).