N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide

C11H15N3O3 — CID 78994089

IUPACN-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide
SMILESNC(=O)NCCNC(=O)Cc1ccccc1O
InChIInChI=1S/C11H15N3O3/c12-11(17)14-6-5-13-10(16)7-8-3-1-2-4-9(8)15/h1-4,15H,5-7H2,(H,13,16)(H3,12,14,17)
InChIKeyKKRXSEITILLQDB-UHFFFAOYSA-N
MW237.26 g/mol
LogP-0.28
Rot. Bonds5

About N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide

N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide (PubChem CID 78994089) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide
PubChem CID78994089
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC NameN-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide
SMILESNC(=O)NCCNC(=O)Cc1ccccc1O
InChIInChI=1S/C11H15N3O3/c12-11(17)14-6-5-13-10(16)7-8-3-1-2-4-9(8)15/h1-4,15H,5-7H2,(H,13,16)(H3,12,14,17)
InChIKeyKKRXSEITILLQDB-UHFFFAOYSA-N
XLogP-0.28
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 5-0.28
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-amino-2-oxoethyl)-2-(2-hydroxyphenyl)acetamide
CID 78993716
N-(3-aminobutyl)-2-(2-hydroxyphenyl)acetamide
CID 80741503
2-[2-[[2-(carbamoylamino)ethylcarbamoylamino]methyl]phenyl]acetic acid
CID 83113961
tert-butyl N-[2-[[2-(2-hydroxyphenyl)acetyl]amino]ethyl]carbamate
CID 52859596
N-[2-(2-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide
CID 78990913
ethyl 3-[[2-(2-hydroxyphenyl)acetyl]amino]propanoate
CID 78916962
3-(2-aminophenyl)-N-[2-(carbamoylamino)ethyl]propanamide
CID 83114772
N-[2-(2-chloroethoxy)ethyl]-2-(2-hydroxyphenyl)acetamide
CID 114297434
N-(3-hydroxy-4-methylpentyl)-2-(2-hydroxyphenyl)acetamide
CID 111662196
[2-(aminomethyl)phenyl]methylurea
CID 62949906
N-[2-(carbamoylamino)ethyl]-2-(4-sulfanylphenyl)acetamide
CID 107034090
2-(2-hydroxyphenyl)-N-(2-methylpropyl)acetamide
CID 22947307

Frequently Asked Questions

What is the IUPAC name of N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide?
The IUPAC name of N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide (CID 78994089) is N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide.
What is the SMILES notation for N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide?
The canonical SMILES for N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide is NC(=O)NCCNC(=O)Cc1ccccc1O.
What is the InChIKey of N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide?
The InChIKey is KKRXSEITILLQDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c12-11(17)14-6-5-13-10(16)7-8-3-1-2-4-9(8)15/h1-4,15H,5-7H2,(H,13,16)(H3,12,14,17).
What are the key properties of N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide?
N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide has a molecular weight of 237.26 g/mol, XLogP of -0.28, 5 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(carbamoylamino)ethyl]-2-(2-hydroxyphenyl)acetamide is sourced from PubChem (CID 78994089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).