(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone

C14H17FN4O2 — CID 139020979

IUPAC(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone
SMILESO=C(c1ccnc(N2CCOCC2)n1)N1CCC=C(F)C1
InChIInChI=1S/C14H17FN4O2/c15-11-2-1-5-19(10-11)13(20)12-3-4-16-14(17-12)18-6-8-21-9-7-18/h2-4H,1,5-10H2
InChIKeyYEUANHGFVOXOQK-UHFFFAOYSA-N
MW292.31 g/mol
LogP1.01
Rot. Bonds2

About (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone

(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone (PubChem CID 139020979) has the molecular formula C14H17FN4O2 and a molecular weight of 292.31 g/mol. Its IUPAC name is (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone.

Molecular Properties

Compound Name(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone
PubChem CID139020979
Molecular FormulaC14H17FN4O2
Molecular Weight292.31 g/mol
Exact Mass292.13
IUPAC Name(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone
SMILESO=C(c1ccnc(N2CCOCC2)n1)N1CCC=C(F)C1
InChIInChI=1S/C14H17FN4O2/c15-11-2-1-5-19(10-11)13(20)12-3-4-16-14(17-12)18-6-8-21-9-7-18/h2-4H,1,5-10H2
InChIKeyYEUANHGFVOXOQK-UHFFFAOYSA-N
XLogP1.01
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.31
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(cyclopropylmethyl)-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 162650117
2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)pyrimidine-4-carboxamide
CID 47256757
4-[(2-Isopropylpyrimidin-4-yl)carbonyl]-2,2-dimethylmorpholine
CID 91828457
[(2S)-2,4-dimethylpiperazin-1-yl]-(2-methylpyrimidin-4-yl)methanone
CID 97074666
2-[methyl-[(1S)-1-pyrimidin-4-ylethyl]amino]-1-morpholin-4-ylethanone
CID 124752356
N-{2-[(Oxan-4-YL)[1-(propan-2-YL)piperidin-4-YL]amino]ethyl}pyrimidine-4-carboxamide
CID 132440217
(2-cyclopropylpyrimidin-4-yl)-[(3S)-3-ethyl-3-methylmorpholin-4-yl]methanone
CID 164630523
Piperazin-1-yl-[2-(trifluoromethyl)pyrimidin-4-yl]methanone
CID 110833891
[(3R,4S)-3-fluoro-4-propan-2-yloxypiperidin-1-yl]-pyrimidin-4-ylmethanone
CID 121261823
N-(2-fluoro-1-methoxyethyl)pyrimidine-4-carboxamide
CID 140723002
(3-Fluoropiperidin-1-yl)-[2-(trifluoromethyl)pyrimidin-4-yl]methanone
CID 141316566
[2-(Fluoromethyl)pyrimidin-4-yl]-(4-methylpiperazin-1-yl)methanone
CID 155689299

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone?
The IUPAC name of (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone (CID 139020979) is (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone.
What is the SMILES notation for (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone?
The canonical SMILES for (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone is O=C(c1ccnc(N2CCOCC2)n1)N1CCC=C(F)C1.
What is the InChIKey of (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone?
The InChIKey is YEUANHGFVOXOQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4O2/c15-11-2-1-5-19(10-11)13(20)12-3-4-16-14(17-12)18-6-8-21-9-7-18/h2-4H,1,5-10H2.
What are the key properties of (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone?
(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone has a molecular weight of 292.31 g/mol, XLogP of 1.01, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-(2-morpholin-4-ylpyrimidin-4-yl)methanone is sourced from PubChem (CID 139020979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).