N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide

C19H23NO3 — CID 19452624

IUPACN-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide
SMILESCc1ccc(C)c(OCc2ccc(C(=O)NC3CCCC3)o2)c1
InChIInChI=1S/C19H23NO3/c1-13-7-8-14(2)18(11-13)22-12-16-9-10-17(23-16)19(21)20-15-5-3-4-6-15/h7-11,15H,3-6,12H2,1-2H3,(H,20,21)
InChIKeyQNJZGHFEIIHIQQ-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.15
Rot. Bonds5

About N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide

N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide (PubChem CID 19452624) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide
PubChem CID19452624
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide
SMILESCc1ccc(C)c(OCc2ccc(C(=O)NC3CCCC3)o2)c1
InChIInChI=1S/C19H23NO3/c1-13-7-8-14(2)18(11-13)22-12-16-9-10-17(23-16)19(21)20-15-5-3-4-6-15/h7-11,15H,3-6,12H2,1-2H3,(H,20,21)
InChIKeyQNJZGHFEIIHIQQ-UHFFFAOYSA-N
XLogP4.15
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(4-chloro-2-methylphenoxy)methyl]-N-cyclohexylfuran-2-carboxamide
CID 19457491
4-[[5-[(2,4-dimethylphenoxy)methyl]furan-2-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 119230206
N-butyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide
CID 19452808
N-cyclooctyl-5-(methoxymethyl)furan-2-carboxamide
CID 86912047
N-butan-2-yl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide
CID 19452717
N-(8-azabicyclo[3.2.1]octan-3-yl)-5-[(2,4-dimethylphenoxy)methyl]furan-2-carboxamide;hydrochloride
CID 119458931
N-(2,6-dichlorophenyl)-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide
CID 19452643
N-cycloheptyl-5-[(2,4-difluorophenoxy)methyl]furan-2-carboxamide
CID 19453107
5-[(2,4-dimethylphenoxy)methyl]-N-(2-methylpiperidin-4-yl)furan-2-carboxamide
CID 120600343
azepan-1-yl-[5-[(2,5-dimethylphenoxy)methyl]furan-2-yl]methanone
CID 35524316
N-cyclohexyl-5-(phenoxymethyl)furan-2-carboxamide
CID 24980847
N-[[5-[(2,5-dimethylphenoxy)methyl]furan-2-yl]methyl]cyclopropanamine
CID 62453576

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide?
The IUPAC name of N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide (CID 19452624) is N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide?
The canonical SMILES for N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide is Cc1ccc(C)c(OCc2ccc(C(=O)NC3CCCC3)o2)c1.
What is the InChIKey of N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide?
The InChIKey is QNJZGHFEIIHIQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-13-7-8-14(2)18(11-13)22-12-16-9-10-17(23-16)19(21)20-15-5-3-4-6-15/h7-11,15H,3-6,12H2,1-2H3,(H,20,21).
What are the key properties of N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide?
N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide has a molecular weight of 313.40 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-[(2,5-dimethylphenoxy)methyl]furan-2-carboxamide is sourced from PubChem (CID 19452624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).