N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide

C11H16N2O4 — CID 83202345

IUPACN-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide
SMILESCOCc1cc(C(=O)NOC2CCCC2)no1
InChIInChI=1S/C11H16N2O4/c1-15-7-9-6-10(12-17-9)11(14)13-16-8-4-2-3-5-8/h6,8H,2-5,7H2,1H3,(H,13,14)
InChIKeyBEMFFKSKQVFGMT-UHFFFAOYSA-N
MW240.26 g/mol
LogP1.42
Rot. Bonds5

About N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide

N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide (PubChem CID 83202345) has the molecular formula C11H16N2O4 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide
PubChem CID83202345
Molecular FormulaC11H16N2O4
Molecular Weight240.26 g/mol
Exact Mass240.11
IUPAC NameN-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide
SMILESCOCc1cc(C(=O)NOC2CCCC2)no1
InChIInChI=1S/C11H16N2O4/c1-15-7-9-6-10(12-17-9)11(14)13-16-8-4-2-3-5-8/h6,8H,2-5,7H2,1H3,(H,13,14)
InChIKeyBEMFFKSKQVFGMT-UHFFFAOYSA-N
XLogP1.42
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(2-hydroxycyclohexyl)methyl]-5-(methoxymethyl)-1,2-oxazole-3-carboxamide
CID 66156374
N-[4-(ethylamino)cyclohexyl]-5-(methoxymethyl)-1,2-oxazole-3-carboxamide
CID 66155543
N-[(3-hydroxycyclohexyl)methyl]-5-(methoxymethyl)-1,2-oxazole-3-carboxamide
CID 103707640
N-[cyano(cyclohexyl)methyl]-5-(methoxymethyl)-1,2-oxazole-3-carboxamide
CID 66157343
N-[1-(aminomethyl)cyclopentyl]-5-(methoxymethyl)-1,2-oxazole-3-carboxamide
CID 66158360
methyl 5-(methoxymethyl)-1,2-oxazole-3-carboxylate
CID 13371025
methyl 2-[[5-(methoxymethyl)-1,2-oxazole-3-carbonyl]amino]propanoate
CID 66156389
N-[1-(aminomethyl)cyclopentyl]-5-(methoxymethyl)-1,2-oxazole-3-carboxamide;hydrochloride
CID 119566646
N-[(2S)-1-aminopropan-2-yl]-5-(methoxymethyl)-1,2-oxazole-3-carboxamide
CID 120505183
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-5-(methoxymethyl)-1,2-oxazole-3-carboxamide
CID 103890936
5-(methoxymethyl)-N-(2-phenoxycyclohexyl)-1,2-oxazole-3-carboxamide
CID 75374447
5-(methoxymethyl)-N-(3-oxobutan-2-yl)-1,2-oxazole-3-carboxamide
CID 66157357

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide (CID 83202345) is N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide is COCc1cc(C(=O)NOC2CCCC2)no1.
What is the InChIKey of N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide?
The InChIKey is BEMFFKSKQVFGMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4/c1-15-7-9-6-10(12-17-9)11(14)13-16-8-4-2-3-5-8/h6,8H,2-5,7H2,1H3,(H,13,14).
What are the key properties of N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide?
N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide has a molecular weight of 240.26 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyloxy-5-(methoxymethyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 83202345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).