N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide

C19H18N2O5 — CID 29479487

IUPACN-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide
SMILESO=C(CNC(=O)c1occc1COc1ccccc1)NCc1ccco1
InChIInChI=1S/C19H18N2O5/c22-17(20-11-16-7-4-9-24-16)12-21-19(23)18-14(8-10-25-18)13-26-15-5-2-1-3-6-15/h1-10H,11-13H2,(H,20,22)(H,21,23)
InChIKeyNFNHWUZAEMRXAG-UHFFFAOYSA-N
MW354.36 g/mol
LogP2.50
Rot. Bonds8

About N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide

N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide (PubChem CID 29479487) has the molecular formula C19H18N2O5 and a molecular weight of 354.36 g/mol. Its IUPAC name is N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide
PubChem CID29479487
Molecular FormulaC19H18N2O5
Molecular Weight354.36 g/mol
Exact Mass354.12
IUPAC NameN-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide
SMILESO=C(CNC(=O)c1occc1COc1ccccc1)NCc1ccco1
InChIInChI=1S/C19H18N2O5/c22-17(20-11-16-7-4-9-24-16)12-21-19(23)18-14(8-10-25-18)13-26-15-5-2-1-3-6-15/h1-10H,11-13H2,(H,20,22)(H,21,23)
InChIKeyNFNHWUZAEMRXAG-UHFFFAOYSA-N
XLogP2.50
TPSA93.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.36
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(diethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide
CID 47079474
N-[2-(methylamino)ethyl]-3-(phenoxymethyl)furan-2-carboxamide
CID 119503301
N-(2-methoxyethyl)-3-(phenoxymethyl)furan-2-carboxamide
CID 51304876
3-(phenoxymethyl)-N-(thiophen-2-ylmethyl)furan-2-carboxamide
CID 30138155
N-[(4-fluorophenyl)methyl]-3-(phenoxymethyl)furan-2-carboxamide
CID 46697697
N-[2-(methylamino)propyl]-3-(phenoxymethyl)furan-2-carboxamide
CID 120832904
N-[[3-(methoxymethyl)phenyl]methyl]-3-(phenoxymethyl)furan-2-carboxamide
CID 46487559
N-[(1,5-dimethylpyrrol-2-yl)methyl]-3-(phenoxymethyl)furan-2-carboxamide
CID 29434158
3-(phenoxymethyl)-N-[[2-(propan-2-yloxymethyl)phenyl]methyl]furan-2-carboxamide
CID 30832733
3-(phenoxymethyl)-N-(2H-triazol-4-ylmethyl)furan-2-carboxamide
CID 75512492
3-[[3-(phenoxymethyl)furan-2-carbonyl]amino]butanoic acid
CID 119220829
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-propoxybenzamide
CID 18118956

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide?
The IUPAC name of N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide (CID 29479487) is N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide?
The canonical SMILES for N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide is O=C(CNC(=O)c1occc1COc1ccccc1)NCc1ccco1.
What is the InChIKey of N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide?
The InChIKey is NFNHWUZAEMRXAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O5/c22-17(20-11-16-7-4-9-24-16)12-21-19(23)18-14(8-10-25-18)13-26-15-5-2-1-3-6-15/h1-10H,11-13H2,(H,20,22)(H,21,23).
What are the key properties of N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide?
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide has a molecular weight of 354.36 g/mol, XLogP of 2.50, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(phenoxymethyl)furan-2-carboxamide is sourced from PubChem (CID 29479487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).