N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide

C19H26N2O3 — CID 20966695

IUPACN-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide
SMILESCc1noc(C)c1Cc1ccc(C(=O)NC2CCCCCCC2)o1
InChIInChI=1S/C19H26N2O3/c1-13-17(14(2)24-21-13)12-16-10-11-18(23-16)19(22)20-15-8-6-4-3-5-7-9-15/h10-11,15H,3-9,12H2,1-2H3,(H,20,22)
InChIKeySFZPTCZEIOVBKA-UHFFFAOYSA-N
MW330.43 g/mol
LogP4.32
Rot. Bonds4

About N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide

N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide (PubChem CID 20966695) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide
PubChem CID20966695
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC NameN-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide
SMILESCc1noc(C)c1Cc1ccc(C(=O)NC2CCCCCCC2)o1
InChIInChI=1S/C19H26N2O3/c1-13-17(14(2)24-21-13)12-16-10-11-18(23-16)19(22)20-15-8-6-4-3-5-7-9-15/h10-11,15H,3-9,12H2,1-2H3,(H,20,22)
InChIKeySFZPTCZEIOVBKA-UHFFFAOYSA-N
XLogP4.32
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide
CID 35537550
5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[(4R)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]furan-2-carboxamide
CID 95384675
N-cyclooctyl-5-(methoxymethyl)furan-2-carboxamide
CID 86912047
N-cyclopentyl-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide
CID 9265218
5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide
CID 35537106
N-cyclohexyl-5-(phenoxymethyl)furan-2-carboxamide
CID 24980847
N-cycloheptyl-5-methyl-4-[(4-methylphenoxy)methyl]-1,2-oxazole-3-carboxamide
CID 19488509
N-cyclohexyl-5-methyl-4-(phenoxymethyl)-1,2-oxazole-3-carboxamide
CID 19486426
[5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-yl]-[(2R)-2-(2-pyrrolidin-1-ylethyl)piperidin-1-yl]methanone
CID 92605819
(1S,11R)-2-[5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carbonyl]-2,9-diazabicyclo[9.4.0]pentadecan-10-one
CID 110201232
5-[(4-tert-butylphenoxy)methyl]-N-cyclohexylfuran-2-carboxamide
CID 998142
N-cyclopentyl-5-[(3,5-dimethylpyrazol-1-yl)methyl]furan-2-carboxamide
CID 19466000

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide?
The IUPAC name of N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide (CID 20966695) is N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide?
The canonical SMILES for N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide is Cc1noc(C)c1Cc1ccc(C(=O)NC2CCCCCCC2)o1.
What is the InChIKey of N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide?
The InChIKey is SFZPTCZEIOVBKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3/c1-13-17(14(2)24-21-13)12-16-10-11-18(23-16)19(22)20-15-8-6-4-3-5-7-9-15/h10-11,15H,3-9,12H2,1-2H3,(H,20,22).
What are the key properties of N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide?
N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide is sourced from PubChem (CID 20966695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).