furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone

C19H19N5O2 — CID 74239566

IUPACfuran-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCCC(Nc2nccc(-c3ccccn3)n2)C1
InChIInChI=1S/C19H19N5O2/c25-18(17-7-4-12-26-17)24-11-3-5-14(13-24)22-19-21-10-8-16(23-19)15-6-1-2-9-20-15/h1-2,4,6-10,12,14H,3,5,11,13H2,(H,21,22,23)
InChIKeyCROGJCXIPJXSCS-UHFFFAOYSA-N
MW349.39 g/mol
LogP2.85
Rot. Bonds4

About furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone

furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone (PubChem CID 74239566) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone
PubChem CID74239566
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC Namefuran-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCCC(Nc2nccc(-c3ccccn3)n2)C1
InChIInChI=1S/C19H19N5O2/c25-18(17-7-4-12-26-17)24-11-3-5-14(13-24)22-19-21-10-8-16(23-19)15-6-1-2-9-20-15/h1-2,4,6-10,12,14H,3,5,11,13H2,(H,21,22,23)
InChIKeyCROGJCXIPJXSCS-UHFFFAOYSA-N
XLogP2.85
TPSA84.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

furan-2-yl-[3-[[4-(methylamino)pyrimidin-2-yl]amino]piperidin-1-yl]methanone
CID 50962643
[(3R)-3-[[4-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]pyrimidin-2-yl]amino]piperidin-1-yl]-(furan-2-yl)methanone
CID 57463092
[3-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]-(furan-2-yl)methanone
CID 134697643
[(3S)-3-[(4-chloro-1H-pyrrolo[2,3-b]pyridin-6-yl)amino]piperidin-1-yl]-(furan-2-yl)methanone
CID 95719033
N-[1-(furan-2-carbonyl)piperidin-3-yl]azepane-1-sulfonamide
CID 131927041
[4-(furan-2-carbonyl)-1,4-diazepan-1-yl]-pyridin-2-ylmethanone
CID 110807707
(3-chloropiperidin-1-yl)-(furan-2-yl)methanone
CID 63392823
[(3S)-3-[(2-amino-6-morpholin-4-ylpyrimidin-4-yl)amino]piperidin-1-yl]-(furan-2-yl)methanone
CID 95119604
furan-2-yl-[(3S)-3-phenylpiperidin-1-yl]methanone
CID 740547
(2S)-1-(furan-2-carbonyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 55937479
furan-2-yl-[(3R,5R)-3-(pyrimidin-2-ylamino)-1-oxa-9-azaspiro[4.5]decan-9-yl]methanone
CID 97371695
N-[1-(furan-2-carbonyl)piperidin-3-yl]-1H-pyrrole-2-carboxamide
CID 131936035

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone?
The IUPAC name of furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone (CID 74239566) is furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone is O=C(c1ccco1)N1CCCC(Nc2nccc(-c3ccccn3)n2)C1.
What is the InChIKey of furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone?
The InChIKey is CROGJCXIPJXSCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2/c25-18(17-7-4-12-26-17)24-11-3-5-14(13-24)22-19-21-10-8-16(23-19)15-6-1-2-9-20-15/h1-2,4,6-10,12,14H,3,5,11,13H2,(H,21,22,23).
What are the key properties of furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone?
furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone has a molecular weight of 349.39 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]piperidin-1-yl]methanone is sourced from PubChem (CID 74239566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).