5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide

C21H22N2O4 — CID 78872272

IUPAC5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide
SMILESCOCc1ccc(C(=O)NC(C)c2ccc(OCc3cccnc3)cc2)o1
InChIInChI=1S/C21H22N2O4/c1-15(23-21(24)20-10-9-19(27-20)14-25-2)17-5-7-18(8-6-17)26-13-16-4-3-11-22-12-16/h3-12,15H,13-14H2,1-2H3,(H,23,24)
InChIKeyKKBDACKAWSJUEA-UHFFFAOYSA-N
MW366.42 g/mol
LogP3.89
Rot. Bonds8

About 5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide

5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide (PubChem CID 78872272) has the molecular formula C21H22N2O4 and a molecular weight of 366.42 g/mol. Its IUPAC name is 5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide
PubChem CID78872272
Molecular FormulaC21H22N2O4
Molecular Weight366.42 g/mol
Exact Mass366.16
IUPAC Name5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide
SMILESCOCc1ccc(C(=O)NC(C)c2ccc(OCc3cccnc3)cc2)o1
InChIInChI=1S/C21H22N2O4/c1-15(23-21(24)20-10-9-19(27-20)14-25-2)17-5-7-18(8-6-17)26-13-16-4-3-11-22-12-16/h3-12,15H,13-14H2,1-2H3,(H,23,24)
InChIKeyKKBDACKAWSJUEA-UHFFFAOYSA-N
XLogP3.89
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide
CID 55692986
5-(methoxymethyl)-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]furan-2-carboxamide
CID 78876213
N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]-2H-chromene-3-carboxamide
CID 55706047
2-propan-2-ylsulfanyl-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]benzamide
CID 55967852
2,5-dimethyl-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]benzamide
CID 46454003
1-(2,2-difluoroethyl)-1-methyl-3-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]urea
CID 71879259
1-(2,2-difluoroethyl)-1-methyl-3-[(1S)-1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]urea
CID 97020773
4-bromo-5-propan-2-yl-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]-1H-pyrazole-3-carboxamide
CID 56567640
5-[(2-methoxyphenoxy)methyl]-N-[(1S)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide
CID 35529733
5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide
CID 35529730
N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]-3-(pyrimidin-2-ylamino)propanamide
CID 55838629
methyl 2-methyl-4-propyl-5-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethylcarbamoyl]-1H-pyrrole-3-carboxylate
CID 55838885

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide?
The IUPAC name of 5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide (CID 78872272) is 5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide.
What is the SMILES notation for 5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide?
The canonical SMILES for 5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide is COCc1ccc(C(=O)NC(C)c2ccc(OCc3cccnc3)cc2)o1.
What is the InChIKey of 5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide?
The InChIKey is KKBDACKAWSJUEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O4/c1-15(23-21(24)20-10-9-19(27-20)14-25-2)17-5-7-18(8-6-17)26-13-16-4-3-11-22-12-16/h3-12,15H,13-14H2,1-2H3,(H,23,24).
What are the key properties of 5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide?
5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide has a molecular weight of 366.42 g/mol, XLogP of 3.89, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]furan-2-carboxamide is sourced from PubChem (CID 78872272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).