N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide

C14H16N4O3 — CID 20959394

IUPACN-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide
SMILESO=C(NCc1ccco1)c1cnc(N2CCOCC2)nc1
InChIInChI=1S/C14H16N4O3/c19-13(15-10-12-2-1-5-21-12)11-8-16-14(17-9-11)18-3-6-20-7-4-18/h1-2,5,8-9H,3-4,6-7,10H2,(H,15,19)
InChIKeyHVTPLCKSOPYXON-UHFFFAOYSA-N
MW288.31 g/mol
LogP0.84
Rot. Bonds4

About N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide

N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide (PubChem CID 20959394) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide
PubChem CID20959394
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC NameN-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide
SMILESO=C(NCc1ccco1)c1cnc(N2CCOCC2)nc1
InChIInChI=1S/C14H16N4O3/c19-13(15-10-12-2-1-5-21-12)11-8-16-14(17-9-11)18-3-6-20-7-4-18/h1-2,5,8-9H,3-4,6-7,10H2,(H,15,19)
InChIKeyHVTPLCKSOPYXON-UHFFFAOYSA-N
XLogP0.84
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(furan-2-ylmethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide
CID 109254918
2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(furan-2-ylmethyl)pyrimidine-5-carboxamide
CID 109254907
N-[3-(furan-2-ylmethylsulfanyl)propyl]-2-morpholin-4-ylpyrimidine-5-carboxamide
CID 74236548
N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114455
N-(furan-2-ylmethyl)-2-(propan-2-ylamino)pyrimidine-5-carboxamide
CID 109247083
N-(furan-2-ylmethyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide
CID 109082801
N-(furan-2-ylmethyl)-4-piperidin-1-ylbenzamide
CID 53282405
N-(furan-2-ylmethyl)-6-(oxan-4-ylmethoxy)pyridine-3-carboxamide
CID 91815405
2-morpholin-4-yl-N-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)pyrimidine-5-carboxamide
CID 138380473
N-(furan-2-ylmethyl)-4-(6-piperidin-1-yl-3-pyridinyl)benzamide
CID 53149916
N-(furan-2-ylmethyl)-6-(2-morpholin-4-ylethylamino)pyrimidine-4-carboxamide
CID 109344416
2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-(pyridin-2-ylmethyl)pyrimidine-5-carboxamide
CID 109258548

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide (CID 20959394) is N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide is O=C(NCc1ccco1)c1cnc(N2CCOCC2)nc1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide?
The InChIKey is HVTPLCKSOPYXON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c19-13(15-10-12-2-1-5-21-12)11-8-16-14(17-9-11)18-3-6-20-7-4-18/h1-2,5,8-9H,3-4,6-7,10H2,(H,15,19).
What are the key properties of N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide?
N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide has a molecular weight of 288.31 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide is sourced from PubChem (CID 20959394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).