N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide

C16H19NO3 — CID 19454672

IUPACN-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide
SMILESCCCc1ccc(OCc2ccc(C(=O)NC)o2)cc1
InChIInChI=1S/C16H19NO3/c1-3-4-12-5-7-13(8-6-12)19-11-14-9-10-15(20-14)16(18)17-2/h5-10H,3-4,11H2,1-2H3,(H,17,18)
InChIKeyDXDZCFCYNPKJMY-UHFFFAOYSA-N
MW273.33 g/mol
LogP3.17
Rot. Bonds6

About N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide

N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide (PubChem CID 19454672) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide
PubChem CID19454672
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC NameN-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide
SMILESCCCc1ccc(OCc2ccc(C(=O)NC)o2)cc1
InChIInChI=1S/C16H19NO3/c1-3-4-12-5-7-13(8-6-12)19-11-14-9-10-15(20-14)16(18)17-2/h5-10H,3-4,11H2,1-2H3,(H,17,18)
InChIKeyDXDZCFCYNPKJMY-UHFFFAOYSA-N
XLogP3.17
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-5-(phenoxymethyl)furan-2-carboxamide
CID 7678218
N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide
CID 19454573
5-[(4-ethoxyphenoxy)methyl]furan-2-carbohydrazide
CID 5104781
5-[(4-methylphenoxy)methyl]-N-propylfuran-2-carboxamide
CID 2200397
N-[1-(2-ethylpyrazol-3-yl)ethyl]-5-[(4-propylphenoxy)methyl]furan-2-carboxamide
CID 19454649
5-[(4-propylphenoxy)methyl]-N-[(E)-pyridin-3-ylmethylideneamino]furan-2-carboxamide
CID 6874482
5-ethyl-N-methylfuran-2-carboxamide
CID 60751451
diethyl 3-methyl-5-[[5-[(4-propylphenoxy)methyl]furan-2-carbonyl]amino]thiophene-2,4-dicarboxylate
CID 19452868
N'-(4-butoxybenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 9219874
5-[(4-propylphenoxy)methyl]-N-[(E)-(2,3,4-trimethoxyphenyl)methylideneamino]furan-2-carboxamide
CID 6874738
1-[[(2S)-oxolan-2-yl]methyl]-3-[[5-[(4-propylphenoxy)methyl]furan-2-carbonyl]amino]thiourea
CID 40654999
5-[(4-ethylphenoxy)methyl]-N-(2-sulfanylethyl)furan-2-carboxamide
CID 19446639

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide?
The IUPAC name of N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide (CID 19454672) is N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide.
What is the SMILES notation for N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide?
The canonical SMILES for N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide is CCCc1ccc(OCc2ccc(C(=O)NC)o2)cc1.
What is the InChIKey of N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide?
The InChIKey is DXDZCFCYNPKJMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-3-4-12-5-7-13(8-6-12)19-11-14-9-10-15(20-14)16(18)17-2/h5-10H,3-4,11H2,1-2H3,(H,17,18).
What are the key properties of N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide?
N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide has a molecular weight of 273.33 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[(4-propylphenoxy)methyl]furan-2-carboxamide is sourced from PubChem (CID 19454672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).