N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide

C14H15N5O3 — CID 131901507

IUPACN-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide
SMILESO=C(CCCn1cncn1)NCc1cc(-c2ccco2)on1
InChIInChI=1S/C14H15N5O3/c20-14(4-1-5-19-10-15-9-17-19)16-8-11-7-13(22-18-11)12-3-2-6-21-12/h2-3,6-7,9-10H,1,4-5,8H2,(H,16,20)
InChIKeyYTEZIJXVKJUPSC-UHFFFAOYSA-N
MW301.31 g/mol
LogP1.62
Rot. Bonds7

About N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide

N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide (PubChem CID 131901507) has the molecular formula C14H15N5O3 and a molecular weight of 301.31 g/mol. Its IUPAC name is N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide.

Molecular Properties

Compound NameN-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide
PubChem CID131901507
Molecular FormulaC14H15N5O3
Molecular Weight301.31 g/mol
Exact Mass301.12
IUPAC NameN-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide
SMILESO=C(CCCn1cncn1)NCc1cc(-c2ccco2)on1
InChIInChI=1S/C14H15N5O3/c20-14(4-1-5-19-10-15-9-17-19)16-8-11-7-13(22-18-11)12-3-2-6-21-12/h2-3,6-7,9-10H,1,4-5,8H2,(H,16,20)
InChIKeyYTEZIJXVKJUPSC-UHFFFAOYSA-N
XLogP1.62
TPSA98.98 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.31
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide with MolForge

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Related Compounds

N-[(2-phenyl-1,3-oxazol-4-yl)methyl]-4-(1,2,4-triazol-1-yl)butanamide
CID 91793199
N-(2,1,3-benzoxadiazol-5-ylmethyl)-4-(1,2,4-triazol-1-yl)butanamide
CID 91762133
N-[[5-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide
CID 135112950
2-(1,2-benzoxazol-3-yl)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]acetamide
CID 45497837
N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2,3-dimethylbutanamide
CID 118334208
1-[5-(furan-2-yl)-1,2-oxazol-3-yl]-N-methylmethanamine
CID 7537518
N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-(2-methoxyphenoxy)acetamide
CID 30608053
4-(1,2,4-triazol-1-yl)butanehydrazide
CID 63572043
N-(3-hydroxypropyl)-4-(1,2,4-triazol-1-yl)butanamide
CID 110899828
N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-6-oxopyran-3-carboxamide
CID 45496871
2-(2,4-dichlorophenoxy)-N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]acetamide
CID 30608039
1-[4-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylamino]phenyl]butan-1-one
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Frequently Asked Questions

What is the IUPAC name of N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide?
The IUPAC name of N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide (CID 131901507) is N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide.
What is the SMILES notation for N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide?
The canonical SMILES for N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide is O=C(CCCn1cncn1)NCc1cc(-c2ccco2)on1.
What is the InChIKey of N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide?
The InChIKey is YTEZIJXVKJUPSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O3/c20-14(4-1-5-19-10-15-9-17-19)16-8-11-7-13(22-18-11)12-3-2-6-21-12/h2-3,6-7,9-10H,1,4-5,8H2,(H,16,20).
What are the key properties of N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide?
N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide has a molecular weight of 301.31 g/mol, XLogP of 1.62, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-4-(1,2,4-triazol-1-yl)butanamide is sourced from PubChem (CID 131901507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).