3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide

C15H20N4O2 — CID 64546432

IUPAC3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide
SMILESCC1CC1c1ccc(CCC(=O)NCCc2ncn[nH]2)o1
InChIInChI=1S/C15H20N4O2/c1-10-8-12(10)13-4-2-11(21-13)3-5-15(20)16-7-6-14-17-9-18-19-14/h2,4,9-10,12H,3,5-8H2,1H3,(H,16,20)(H,17,18,19)
InChIKeyYKARUXNKNAIFEI-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.81
Rot. Bonds7

About 3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide

3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide (PubChem CID 64546432) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide
PubChem CID64546432
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide
SMILESCC1CC1c1ccc(CCC(=O)NCCc2ncn[nH]2)o1
InChIInChI=1S/C15H20N4O2/c1-10-8-12(10)13-4-2-11(21-13)3-5-15(20)16-7-6-14-17-9-18-19-14/h2,4,9-10,12H,3,5-8H2,1H3,(H,16,20)(H,17,18,19)
InChIKeyYKARUXNKNAIFEI-UHFFFAOYSA-N
XLogP1.81
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide with MolForge

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Related Compounds

4-[3-[5-(2-methylcyclopropyl)furan-2-yl]propanoylamino]butanamide
CID 56812725
N-(3-ethoxypropyl)-3-[5-[(1S,2S)-2-methylcyclopropyl]furan-2-yl]propanamide
CID 94017148
methyl 3-[5-(2-methylcyclopropyl)furan-2-yl]propanoate
CID 112723028
N-methoxy-3-[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]propanamide
CID 94502622
2-methyl-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]cyclopropane-1-carboxamide
CID 64531607
3-[5-[(1S,2S)-2-methylcyclopropyl]furan-2-yl]-N-(4-methyl-2-pyridinyl)propanamide
CID 25340722
3-[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]-N-(4-methyl-2-pyridinyl)propanamide
CID 25340721
N-(2-hydroxy-2-methylpentyl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
CID 103713210
N-butan-2-yl-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
CID 47014175
3-[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 94017153
methyl 4-[[3-[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]propanoylamino]methyl]benzoate
CID 41237032
N-(3-methoxy-1H-1,2,4-triazol-5-yl)-3-[5-(2-methylcyclopropyl)furan-2-yl]propanamide
CID 83097528

Frequently Asked Questions

What is the IUPAC name of 3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide?
The IUPAC name of 3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide (CID 64546432) is 3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide.
What is the SMILES notation for 3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide?
The canonical SMILES for 3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide is CC1CC1c1ccc(CCC(=O)NCCc2ncn[nH]2)o1.
What is the InChIKey of 3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide?
The InChIKey is YKARUXNKNAIFEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-10-8-12(10)13-4-2-11(21-13)3-5-15(20)16-7-6-14-17-9-18-19-14/h2,4,9-10,12H,3,5-8H2,1H3,(H,16,20)(H,17,18,19).
What are the key properties of 3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide?
3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide has a molecular weight of 288.35 g/mol, XLogP of 1.81, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(2-methylcyclopropyl)furan-2-yl]-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]propanamide is sourced from PubChem (CID 64546432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).