N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide

C17H21N3O2 — CID 75437033

IUPACN-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide
SMILESCCc1oc(C(=O)NC(c2nccc(C)n2)C2CC2)cc1C
InChIInChI=1S/C17H21N3O2/c1-4-13-10(2)9-14(22-13)17(21)20-15(12-5-6-12)16-18-8-7-11(3)19-16/h7-9,12,15H,4-6H2,1-3H3,(H,20,21)
InChIKeyOFLRZKUISYQHEU-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.13
Rot. Bonds5

About N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide

N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide (PubChem CID 75437033) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide
PubChem CID75437033
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC NameN-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide
SMILESCCc1oc(C(=O)NC(c2nccc(C)n2)C2CC2)cc1C
InChIInChI=1S/C17H21N3O2/c1-4-13-10(2)9-14(22-13)17(21)20-15(12-5-6-12)16-18-8-7-11(3)19-16/h7-9,12,15H,4-6H2,1-3H3,(H,20,21)
InChIKeyOFLRZKUISYQHEU-UHFFFAOYSA-N
XLogP3.13
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(S)-cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-2,4,5-trifluorobenzamide
CID 97251116
N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-2,4,5-trifluorobenzamide
CID 75395373
5-ethyl-4-methyl-N-[oxan-4-yl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]furan-2-carboxamide
CID 128965577
N-[(R)-cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-2-(3,4-difluorophenyl)acetamide
CID 97330343
N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-2-hydroxybenzamide
CID 75444590
4-acetyl-N-[(R)-cyclopropyl-(4-methylpyrimidin-2-yl)methyl]thiophene-2-carboxamide
CID 97251077
N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-2-(4-hydroxyphenyl)acetamide
CID 75395364
N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-2-(ethylamino)-1,3-thiazole-5-carboxamide
CID 75395361
N-[(S)-cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-2-methyl-1H-pyrrole-3-carboxamide
CID 97251106
N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-methyloxolane-2-carboxamide
CID 84592973
N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]morpholine-4-carboxamide
CID 75521863
(E)-N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-3-(5-methylfuran-2-yl)prop-2-enamide
CID 75395368

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide?
The IUPAC name of N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide (CID 75437033) is N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide.
What is the SMILES notation for N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide?
The canonical SMILES for N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide is CCc1oc(C(=O)NC(c2nccc(C)n2)C2CC2)cc1C.
What is the InChIKey of N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide?
The InChIKey is OFLRZKUISYQHEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-4-13-10(2)9-14(22-13)17(21)20-15(12-5-6-12)16-18-8-7-11(3)19-16/h7-9,12,15H,4-6H2,1-3H3,(H,20,21).
What are the key properties of N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide?
N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide has a molecular weight of 299.37 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl-(4-methylpyrimidin-2-yl)methyl]-5-ethyl-4-methylfuran-2-carboxamide is sourced from PubChem (CID 75437033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).