2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide

C21H21N3O3 — CID 7971062

IUPAC2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide
SMILESO=C(CNC(c1ccccc1)c1ccccc1)NC(=O)NCc1ccco1
InChIInChI=1S/C21H21N3O3/c25-19(24-21(26)23-14-18-12-7-13-27-18)15-22-20(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-13,20,22H,14-15H2,(H2,23,24,25,26)
InChIKeyFUPMNIHWHQJUJG-UHFFFAOYSA-N
MW363.42 g/mol
LogP2.98
Rot. Bonds7

About 2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide

2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide (PubChem CID 7971062) has the molecular formula C21H21N3O3 and a molecular weight of 363.42 g/mol. Its IUPAC name is 2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide
PubChem CID7971062
Molecular FormulaC21H21N3O3
Molecular Weight363.42 g/mol
Exact Mass363.16
IUPAC Name2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide
SMILESO=C(CNC(c1ccccc1)c1ccccc1)NC(=O)NCc1ccco1
InChIInChI=1S/C21H21N3O3/c25-19(24-21(26)23-14-18-12-7-13-27-18)15-22-20(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-13,20,22H,14-15H2,(H2,23,24,25,26)
InChIKeyFUPMNIHWHQJUJG-UHFFFAOYSA-N
XLogP2.98
TPSA83.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 52.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-2-ylmethylcarbamoyl)-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9391859
(2S)-2-[[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]propanoic acid
CID 83195218
2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 9306254
2-[[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]amino]pentanoic acid
CID 43631411
N-(furan-2-ylmethyl)-1,1-diphenylmethanamine
CID 15830516
2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(2-methylpropylcarbamoyl)acetamide
CID 8755412
2-[[(S)-furan-2-yl(phenyl)methyl]amino]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide
CID 8756496
2-[[(S)-furan-2-yl(phenyl)methyl]amino]-N-(methylcarbamoyl)acetamide
CID 8755288
N-(butylcarbamoyl)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]acetamide
CID 8756602
N-benzhydryl-2-(furan-2-ylmethylamino)acetamide
CID 1459234
N-(furan-2-ylmethyl)-3,3-diphenylpropanamide
CID 2259031
2-(furan-2-ylmethylcarbamoylamino)-2-phenylacetic acid
CID 61188974

Frequently Asked Questions

What is the IUPAC name of 2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide?
The IUPAC name of 2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide (CID 7971062) is 2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide.
What is the SMILES notation for 2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide?
The canonical SMILES for 2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide is O=C(CNC(c1ccccc1)c1ccccc1)NC(=O)NCc1ccco1.
What is the InChIKey of 2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide?
The InChIKey is FUPMNIHWHQJUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O3/c25-19(24-21(26)23-14-18-12-7-13-27-18)15-22-20(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-13,20,22H,14-15H2,(H2,23,24,25,26).
What are the key properties of 2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide?
2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide has a molecular weight of 363.42 g/mol, XLogP of 2.98, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzhydrylamino)-N-(furan-2-ylmethylcarbamoyl)acetamide is sourced from PubChem (CID 7971062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).