2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide

C18H24N4O3 — CID 70712162

IUPAC2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide
SMILESCc1oc(C(C)C)cc1C(=O)NCc1cc(N2CCOCC2)ncn1
InChIInChI=1S/C18H24N4O3/c1-12(2)16-9-15(13(3)25-16)18(23)19-10-14-8-17(21-11-20-14)22-4-6-24-7-5-22/h8-9,11-12H,4-7,10H2,1-3H3,(H,19,23)
InChIKeyAWWJVWBZVWQZIG-UHFFFAOYSA-N
MW344.42 g/mol
LogP2.27
Rot. Bonds5

About 2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide

2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide (PubChem CID 70712162) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is 2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide
PubChem CID70712162
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC Name2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide
SMILESCc1oc(C(C)C)cc1C(=O)NCc1cc(N2CCOCC2)ncn1
InChIInChI=1S/C18H24N4O3/c1-12(2)16-9-15(13(3)25-16)18(23)19-10-14-8-17(21-11-20-14)22-4-6-24-7-5-22/h8-9,11-12H,4-7,10H2,1-3H3,(H,19,23)
InChIKeyAWWJVWBZVWQZIG-UHFFFAOYSA-N
XLogP2.27
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(5S)-3-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-4,5-dihydro-1,2-oxazole-5-carboxamide
CID 95894343
N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-2,3-dihydro-1H-indene-5-carboxamide
CID 70714984
(2R)-N-cyclopentyl-2-[(6-morpholin-4-ylpyrimidin-4-yl)methylamino]butanamide
CID 95871432
N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 70743209
(2R)-2-(benzimidazol-1-yl)-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]propanamide
CID 95862882
N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-2-methyl-5-propan-2-ylfuran-3-carboxamide
CID 154757430
N-[1-(6-ethylpyrimidin-4-yl)piperidin-4-yl]-5-methyl-1-(oxan-4-yl)pyrazole-4-carboxamide
CID 167870558
N-[(6-methyl-2-pyridinyl)methyl]-4-(6-morpholin-4-ylpyrimidin-4-yl)piperazine-1-carboxamide
CID 136527153
2,5-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]thiophene-3-carboxamide
CID 37274285
2,5-dimethyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide
CID 32585579
5-methyl-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-1,2-oxazole-4-carboxamide
CID 122353746
3-methyl-N-[1-(6-morpholin-4-ylpyrimidin-4-yl)piperidin-3-yl]-1,2-thiazole-4-carboxamide
CID 126769937

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide?
The IUPAC name of 2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide (CID 70712162) is 2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide?
The canonical SMILES for 2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide is Cc1oc(C(C)C)cc1C(=O)NCc1cc(N2CCOCC2)ncn1.
What is the InChIKey of 2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide?
The InChIKey is AWWJVWBZVWQZIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-12(2)16-9-15(13(3)25-16)18(23)19-10-14-8-17(21-11-20-14)22-4-6-24-7-5-22/h8-9,11-12H,4-7,10H2,1-3H3,(H,19,23).
What are the key properties of 2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide?
2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(6-morpholin-4-ylpyrimidin-4-yl)methyl]-5-propan-2-ylfuran-3-carboxamide is sourced from PubChem (CID 70712162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).