N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide

C14H16N4O3 — CID 75519007

IUPACN-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide
SMILESNC(=O)NC(=O)CN(Cc1cccnc1)Cc1ccco1
InChIInChI=1S/C14H16N4O3/c15-14(20)17-13(19)10-18(9-12-4-2-6-21-12)8-11-3-1-5-16-7-11/h1-7H,8-10H2,(H3,15,17,19,20)
InChIKeyAZXCNWWZDFNVJW-UHFFFAOYSA-N
MW288.31 g/mol
LogP0.87
Rot. Bonds6

About N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide

N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide (PubChem CID 75519007) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide
PubChem CID75519007
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC NameN-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide
SMILESNC(=O)NC(=O)CN(Cc1cccnc1)Cc1ccco1
InChIInChI=1S/C14H16N4O3/c15-14(20)17-13(19)10-18(9-12-4-2-6-21-12)8-11-3-1-5-16-7-11/h1-7H,8-10H2,(H3,15,17,19,20)
InChIKeyAZXCNWWZDFNVJW-UHFFFAOYSA-N
XLogP0.87
TPSA101.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[benzyl(furan-2-ylmethyl)amino]-N-carbamoylpropanamide
CID 18126981
2-[bis(furan-2-ylmethyl)amino]-N-methylacetamide
CID 27118866
N-(furan-2-ylmethyl)-4-methylsulfanyl-N-(pyridin-3-ylmethyl)benzamide
CID 78843578
N-[furan-2-ylmethyl(pyridin-3-ylmethyl)sulfamoyl]-N-propylpropan-1-amine
CID 55627832
methyl 4-[3-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]-3-oxoprop-1-enyl]benzoate
CID 76857234
N-[(4-fluoro-1H-benzimidazol-2-yl)methyl]-N-(furan-2-ylmethyl)-1-pyridin-3-ylmethanamine
CID 75519005
N-[4-[(2-pyridin-3-ylacetyl)amino]phenyl]furan-2-carboxamide
CID 17297144
N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 61215927
2-[furan-2-ylmethyl(pyridin-2-ylmethyl)amino]-N-pyrazin-2-ylacetamide
CID 50975744
(E)-3-[4-(furan-2-ylmethylsulfamoyl)phenyl]-N-methyl-N-(pyridin-3-ylmethyl)prop-2-enamide
CID 78784142
1-amino-1-(pyridin-3-ylmethyl)urea
CID 155026143
N-carbamoyl-2-(2-pyridin-3-ylethylamino)acetamide
CID 60913081

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide?
The IUPAC name of N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide (CID 75519007) is N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide.
What is the SMILES notation for N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide?
The canonical SMILES for N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide is NC(=O)NC(=O)CN(Cc1cccnc1)Cc1ccco1.
What is the InChIKey of N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide?
The InChIKey is AZXCNWWZDFNVJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c15-14(20)17-13(19)10-18(9-12-4-2-6-21-12)8-11-3-1-5-16-7-11/h1-7H,8-10H2,(H3,15,17,19,20).
What are the key properties of N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide?
N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide has a molecular weight of 288.31 g/mol, XLogP of 0.87, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[furan-2-ylmethyl(pyridin-3-ylmethyl)amino]acetamide is sourced from PubChem (CID 75519007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).