morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone

C12H19N5O2 — CID 102537912

IUPACmorpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone
SMILESO=C(c1cn(C2CCCNC2)nn1)N1CCOCC1
InChIInChI=1S/C12H19N5O2/c18-12(16-4-6-19-7-5-16)11-9-17(15-14-11)10-2-1-3-13-8-10/h9-10,13H,1-8H2
InChIKeyBDQYPNAQIUAFLC-UHFFFAOYSA-N
MW265.32 g/mol
LogP-0.32
Rot. Bonds2

About morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone

morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone (PubChem CID 102537912) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone
PubChem CID102537912
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Namemorpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone
SMILESO=C(c1cn(C2CCCNC2)nn1)N1CCOCC1
InChIInChI=1S/C12H19N5O2/c18-12(16-4-6-19-7-5-16)11-9-17(15-14-11)10-2-1-3-13-8-10/h9-10,13H,1-8H2
InChIKeyBDQYPNAQIUAFLC-UHFFFAOYSA-N
XLogP-0.32
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(1-piperidin-3-yltriazol-4-yl)ethanone
CID 164663675
[1-(azetidin-3-yl)triazol-4-yl]-(4-methoxypiperidin-1-yl)methanone
CID 79316756
3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl-[1-(azetidin-3-yl)triazol-4-yl]methanone
CID 79318684
[2-(2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidin-1-yl]-(1-piperidin-3-yltriazol-4-yl)methanone
CID 128882361
morpholin-4-yl-[1-[1-(naphthalen-1-ylmethyl)piperidin-3-yl]triazol-4-yl]methanone
CID 45249044
2-[1-[1-(azetidin-3-yl)triazole-4-carbonyl]piperidin-4-yl]acetic acid
CID 79612748
(3S)-1-[1-(azetidin-3-yl)triazole-4-carbonyl]piperidine-3-carboxylic acid
CID 81126368
[1-(azetidin-3-yl)triazol-4-yl]-[4-(methoxymethyl)piperidin-1-yl]methanone
CID 79316632
(1-cyclohexyltriazol-4-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone
CID 56912845
[1-(1-cycloheptylpiperidin-4-yl)triazol-4-yl]-piperidin-1-ylmethanone
CID 26318869
(1-cyclobutyltriazol-4-yl)-[3-(oxetan-3-ylamino)azetidin-1-yl]methanone
CID 167775813
1-[1-(azetidin-3-yl)triazole-4-carbonyl]pyrrolidine-3-carboxylic acid
CID 79316304

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone?
The IUPAC name of morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone (CID 102537912) is morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone.
What is the SMILES notation for morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone?
The canonical SMILES for morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone is O=C(c1cn(C2CCCNC2)nn1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone?
The InChIKey is BDQYPNAQIUAFLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c18-12(16-4-6-19-7-5-16)11-9-17(15-14-11)10-2-1-3-13-8-10/h9-10,13H,1-8H2.
What are the key properties of morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone?
morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone has a molecular weight of 265.32 g/mol, XLogP of -0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-(1-piperidin-3-yltriazol-4-yl)methanone is sourced from PubChem (CID 102537912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).