4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide

C16H19N3O4 — CID 32993957

IUPAC4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide
SMILESCOCCN(Cc1ccco1)C(=O)c1ccc(NC(N)=O)cc1
InChIInChI=1S/C16H19N3O4/c1-22-10-8-19(11-14-3-2-9-23-14)15(20)12-4-6-13(7-5-12)18-16(17)21/h2-7,9H,8,10-11H2,1H3,(H3,17,18,21)
InChIKeyWBLKKHJZJARHCD-UHFFFAOYSA-N
MW317.35 g/mol
LogP2.06
Rot. Bonds7

About 4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide

4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide (PubChem CID 32993957) has the molecular formula C16H19N3O4 and a molecular weight of 317.35 g/mol. Its IUPAC name is 4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound Name4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide
PubChem CID32993957
Molecular FormulaC16H19N3O4
Molecular Weight317.35 g/mol
Exact Mass317.14
IUPAC Name4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide
SMILESCOCCN(Cc1ccco1)C(=O)c1ccc(NC(N)=O)cc1
InChIInChI=1S/C16H19N3O4/c1-22-10-8-19(11-14-3-2-9-23-14)15(20)12-4-6-13(7-5-12)18-16(17)21/h2-7,9H,8,10-11H2,1H3,(H3,17,18,21)
InChIKeyWBLKKHJZJARHCD-UHFFFAOYSA-N
XLogP2.06
TPSA97.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-N-(2-methoxyethyl)benzamide
CID 42773009
(2S)-2-[(4-acetamidophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)propanamide
CID 39408412
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-3,4-dichloro-N-(2-methoxyethyl)benzamide
CID 5055169
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-N-(2-methoxyethyl)-4-pentylbenzamide
CID 4550872
5-[furan-2-ylmethyl(2-methoxyethyl)carbamoyl]pyrazine-2-carboxylic acid
CID 120685085
1-(furan-2-ylmethyl)-1-(2-methoxyethyl)-3-(3-methylbutyl)urea
CID 86999017
N-benzyl-2-[dimethylcarbamoyl(2-methoxyethyl)amino]-N-(furan-2-ylmethyl)acetamide
CID 42773023
3-(1-adamantylmethyl)-1-(furan-2-ylmethyl)-1-(2-methoxyethyl)urea
CID 86999398
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-3,5-dimethoxy-N-(2-methoxyethyl)benzamide
CID 42773017
N-[2-[furan-2-ylmethyl(2-phenylethyl)amino]-2-oxoethyl]-N-(2-methoxyethyl)-4-methylbenzamide
CID 3911576
4-(4-bromophenyl)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-4-oxobutanamide
CID 55587760
N-[2-[furan-2-ylmethyl(2-methoxyethyl)amino]-2-oxoethyl]-2-phenylacetamide
CID 32992758

Frequently Asked Questions

What is the IUPAC name of 4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide?
The IUPAC name of 4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide (CID 32993957) is 4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for 4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide?
The canonical SMILES for 4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide is COCCN(Cc1ccco1)C(=O)c1ccc(NC(N)=O)cc1.
What is the InChIKey of 4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide?
The InChIKey is WBLKKHJZJARHCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O4/c1-22-10-8-19(11-14-3-2-9-23-14)15(20)12-4-6-13(7-5-12)18-16(17)21/h2-7,9H,8,10-11H2,1H3,(H3,17,18,21).
What are the key properties of 4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide?
4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide has a molecular weight of 317.35 g/mol, XLogP of 2.06, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(carbamoylamino)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 32993957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).