N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide

C22H20N2O4 — CID 30804525

IUPACN-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide
SMILESO=C(Nc1cccc(NC(=O)C2CC2)c1)c1occc1COc1ccccc1
InChIInChI=1S/C22H20N2O4/c25-21(15-9-10-15)23-17-5-4-6-18(13-17)24-22(26)20-16(11-12-27-20)14-28-19-7-2-1-3-8-19/h1-8,11-13,15H,9-10,14H2,(H,23,25)(H,24,26)
InChIKeyNFLTXERTDWRFIG-UHFFFAOYSA-N
MW376.41 g/mol
LogP4.46
Rot. Bonds7

About N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide

N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide (PubChem CID 30804525) has the molecular formula C22H20N2O4 and a molecular weight of 376.41 g/mol. Its IUPAC name is N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide
PubChem CID30804525
Molecular FormulaC22H20N2O4
Molecular Weight376.41 g/mol
Exact Mass376.14
IUPAC NameN-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide
SMILESO=C(Nc1cccc(NC(=O)C2CC2)c1)c1occc1COc1ccccc1
InChIInChI=1S/C22H20N2O4/c25-21(15-9-10-15)23-17-5-4-6-18(13-17)24-22(26)20-16(11-12-27-20)14-28-19-7-2-1-3-8-19/h1-8,11-13,15H,9-10,14H2,(H,23,25)(H,24,26)
InChIKeyNFLTXERTDWRFIG-UHFFFAOYSA-N
XLogP4.46
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.41
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,3-benzodioxol-5-yl)-3-(phenoxymethyl)furan-2-carboxamide
CID 25398439
3-(phenoxymethyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]furan-2-carboxamide
CID 38668380
ethyl 3-[[3-(phenoxymethyl)furan-2-carbonyl]amino]benzoate
CID 34202497
N-[4-(cyclopentylmethylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide
CID 56533885
1-[3-(phenoxymethyl)furan-2-carbonyl]-N-(4-sulfamoylphenyl)piperidine-4-carboxamide
CID 55498214
N-[3-(cyclopropanecarbonylamino)phenyl]-2-methylfuran-3-carboxamide
CID 38325558
N-[3-[[2-(trifluoromethyl)phenyl]methoxy]phenyl]cyclopropanecarboxamide
CID 86997534
N-(2,4-dimethylphenyl)-3-(phenoxymethyl)furan-2-carboxamide
CID 17454230
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-3-(phenoxymethyl)furan-2-carboxamide
CID 55856148
3-[(3-cyanophenoxy)methyl]-N-(3-ethylsulfonylphenyl)furan-2-carboxamide
CID 86971496
3-(phenoxymethyl)-N-(1,3,4-thiadiazol-2-yl)furan-2-carboxamide
CID 29370752
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-(phenoxymethyl)furan-2-carboxamide
CID 51314093

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide?
The IUPAC name of N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide (CID 30804525) is N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide?
The canonical SMILES for N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide is O=C(Nc1cccc(NC(=O)C2CC2)c1)c1occc1COc1ccccc1.
What is the InChIKey of N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide?
The InChIKey is NFLTXERTDWRFIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O4/c25-21(15-9-10-15)23-17-5-4-6-18(13-17)24-22(26)20-16(11-12-27-20)14-28-19-7-2-1-3-8-19/h1-8,11-13,15H,9-10,14H2,(H,23,25)(H,24,26).
What are the key properties of N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide?
N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide has a molecular weight of 376.41 g/mol, XLogP of 4.46, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopropanecarbonylamino)phenyl]-3-(phenoxymethyl)furan-2-carboxamide is sourced from PubChem (CID 30804525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).