[2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone

C16H21N5O2 — CID 110097811

IUPAC[2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone
SMILESCN(C)c1cccc(C2CN(C(=O)c3cnn(C)c3)CCO2)n1
InChIInChI=1S/C16H21N5O2/c1-19(2)15-6-4-5-13(18-15)14-11-21(7-8-23-14)16(22)12-9-17-20(3)10-12/h4-6,9-10,14H,7-8,11H2,1-3H3
InChIKeyKKKCNCFHBSKAAO-UHFFFAOYSA-N
MW315.38 g/mol
LogP1.09
Rot. Bonds3

About [2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone

[2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone (PubChem CID 110097811) has the molecular formula C16H21N5O2 and a molecular weight of 315.38 g/mol. Its IUPAC name is [2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone.

Molecular Properties

Compound Name[2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone
PubChem CID110097811
Molecular FormulaC16H21N5O2
Molecular Weight315.38 g/mol
Exact Mass315.17
IUPAC Name[2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone
SMILESCN(C)c1cccc(C2CN(C(=O)c3cnn(C)c3)CCO2)n1
InChIInChI=1S/C16H21N5O2/c1-19(2)15-6-4-5-13(18-15)14-11-21(7-8-23-14)16(22)12-9-17-20(3)10-12/h4-6,9-10,14H,7-8,11H2,1-3H3
InChIKeyKKKCNCFHBSKAAO-UHFFFAOYSA-N
XLogP1.09
TPSA63.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

[2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(5-methyl-3-pyridinyl)methanone
CID 110112057
[(2R)-2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-pyrazin-2-ylmethanone
CID 125008999
[(2R)-2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-thiophen-2-ylmethanone
CID 124997234
[(2S)-2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(3-fluoro-4-methoxyphenyl)methanone
CID 125016156
[(2R)-2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-propylpyrazol-3-yl)methanone
CID 124952383
[(2S)-2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1H-indazol-3-yl)methanone
CID 124950048
1-[2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-2-pyridin-3-yloxyethanone
CID 110112558
[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone
CID 110104959
(1-methylpyrazol-4-yl)-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone
CID 75501601
[2-[2-[2-(dimethylamino)-4-pyridinyl]ethyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone
CID 110114065
1-[(2S)-2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-3-(3-methylpyrazol-1-yl)propan-1-one
CID 124940912
[(2R)-2-[5-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(2-methylpyrazol-3-yl)methanone
CID 95847868

Frequently Asked Questions

What is the IUPAC name of [2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone?
The IUPAC name of [2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone (CID 110097811) is [2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone.
What is the SMILES notation for [2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone?
The canonical SMILES for [2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone is CN(C)c1cccc(C2CN(C(=O)c3cnn(C)c3)CCO2)n1.
What is the InChIKey of [2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone?
The InChIKey is KKKCNCFHBSKAAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O2/c1-19(2)15-6-4-5-13(18-15)14-11-21(7-8-23-14)16(22)12-9-17-20(3)10-12/h4-6,9-10,14H,7-8,11H2,1-3H3.
What are the key properties of [2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone?
[2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone has a molecular weight of 315.38 g/mol, XLogP of 1.09, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[6-(dimethylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone is sourced from PubChem (CID 110097811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).