[2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone

C15H22N6O2 — CID 166252933

IUPAC[2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone
SMILESCN(C)CCCC1CN(C(=O)c2cccn3nnnc23)CCO1
InChIInChI=1S/C15H22N6O2/c1-19(2)7-3-5-12-11-20(9-10-23-12)15(22)13-6-4-8-21-14(13)16-17-18-21/h4,6,8,12H,3,5,7,9-11H2,1-2H3
InChIKeyZXVYJWITFCHEAY-UHFFFAOYSA-N
MW318.38 g/mol
LogP0.31
Rot. Bonds5

About [2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone

[2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone (PubChem CID 166252933) has the molecular formula C15H22N6O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is [2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone.

Molecular Properties

Compound Name[2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone
PubChem CID166252933
Molecular FormulaC15H22N6O2
Molecular Weight318.38 g/mol
Exact Mass318.18
IUPAC Name[2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone
SMILESCN(C)CCCC1CN(C(=O)c2cccn3nnnc23)CCO1
InChIInChI=1S/C15H22N6O2/c1-19(2)7-3-5-12-11-20(9-10-23-12)15(22)13-6-4-8-21-14(13)16-17-18-21/h4,6,8,12H,3,5,7,9-11H2,1-2H3
InChIKeyZXVYJWITFCHEAY-UHFFFAOYSA-N
XLogP0.31
TPSA75.86 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 50.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of [2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone?
The IUPAC name of [2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone (CID 166252933) is [2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone.
What is the SMILES notation for [2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone?
The canonical SMILES for [2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone is CN(C)CCCC1CN(C(=O)c2cccn3nnnc23)CCO1.
What is the InChIKey of [2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone?
The InChIKey is ZXVYJWITFCHEAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N6O2/c1-19(2)7-3-5-12-11-20(9-10-23-12)15(22)13-6-4-8-21-14(13)16-17-18-21/h4,6,8,12H,3,5,7,9-11H2,1-2H3.
What are the key properties of [2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone?
[2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone has a molecular weight of 318.38 g/mol, XLogP of 0.31, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[3-(dimethylamino)propyl]morpholin-4-yl]-(tetrazolo[1,5-a]pyridin-8-yl)methanone is sourced from PubChem (CID 166252933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).