N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide

C10H15N3O3 — CID 62687549

IUPACN-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide
SMILESCN(CCN)CC(=O)NC(=O)c1ccco1
InChIInChI=1S/C10H15N3O3/c1-13(5-4-11)7-9(14)12-10(15)8-3-2-6-16-8/h2-3,6H,4-5,7,11H2,1H3,(H,12,14,15)
InChIKeyDJCQMRCRQWXBKR-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.57
Rot. Bonds5

About N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide

N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide (PubChem CID 62687549) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide
PubChem CID62687549
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC NameN-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide
SMILESCN(CCN)CC(=O)NC(=O)c1ccco1
InChIInChI=1S/C10H15N3O3/c1-13(5-4-11)7-9(14)12-10(15)8-3-2-6-16-8/h2-3,6H,4-5,7,11H2,1H3,(H,12,14,15)
InChIKeyDJCQMRCRQWXBKR-UHFFFAOYSA-N
XLogP-0.57
TPSA88.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[1-hydroxypropan-2-yl(methyl)amino]acetyl]furan-2-carboxamide
CID 104554025
N-[2-[2-aminoethyl(methyl)amino]acetyl]-1H-pyrrole-2-carboxamide
CID 62686626
S-[2-(furan-2-carbonylamino)-2-oxoethyl] ethanethioate
CID 23347862
N-[benzyl(methyl)carbamothioyl]furan-2-carboxamide
CID 923050
N-(2-aminoethyl)-N-ethylfuran-2-carboxamide
CID 28707635
[2-(furan-2-carbonylamino)-2-oxoethyl] 2-[(4-acetylphenyl)sulfonyl-methylamino]acetate
CID 55546945
N-(1-aminopentan-3-yl)furan-2-carboxamide
CID 62653791
1-(furan-2-carbonylamino)-1-methylurea
CID 130751768
N-(ethylcarbamoyl)furan-2-carboxamide
CID 131178690
N-[methyl(phenyl)carbamoyl]furan-2-carboxamide
CID 110866312
N-[di(propan-2-yl)carbamothioyl]furan-2-carboxamide
CID 19187806
N-[2-(3-aminopropanoylamino)ethyl]furan-2-carboxamide;hydrochloride
CID 119278257

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide?
The IUPAC name of N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide (CID 62687549) is N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide?
The canonical SMILES for N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide is CN(CCN)CC(=O)NC(=O)c1ccco1.
What is the InChIKey of N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide?
The InChIKey is DJCQMRCRQWXBKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-13(5-4-11)7-9(14)12-10(15)8-3-2-6-16-8/h2-3,6H,4-5,7,11H2,1H3,(H,12,14,15).
What are the key properties of N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide?
N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide has a molecular weight of 225.25 g/mol, XLogP of -0.57, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-aminoethyl(methyl)amino]acetyl]furan-2-carboxamide is sourced from PubChem (CID 62687549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).