4-amino-N-[4-(carbamoylamino)phenyl]butanamide

C11H16N4O2 — CID 43711123

IUPAC4-amino-N-[4-(carbamoylamino)phenyl]butanamide
SMILESNCCCC(=O)Nc1ccc(NC(N)=O)cc1
InChIInChI=1S/C11H16N4O2/c12-7-1-2-10(16)14-8-3-5-9(6-4-8)15-11(13)17/h3-6H,1-2,7,12H2,(H,14,16)(H3,13,15,17)
InChIKeyPWULYNGCPLZGFM-UHFFFAOYSA-N
MW236.28 g/mol
LogP0.85
Rot. Bonds5

About 4-amino-N-[4-(carbamoylamino)phenyl]butanamide

4-amino-N-[4-(carbamoylamino)phenyl]butanamide (PubChem CID 43711123) has the molecular formula C11H16N4O2 and a molecular weight of 236.28 g/mol. Its IUPAC name is 4-amino-N-[4-(carbamoylamino)phenyl]butanamide.

Molecular Properties

Compound Name4-amino-N-[4-(carbamoylamino)phenyl]butanamide
PubChem CID43711123
Molecular FormulaC11H16N4O2
Molecular Weight236.28 g/mol
Exact Mass236.13
IUPAC Name4-amino-N-[4-(carbamoylamino)phenyl]butanamide
SMILESNCCCC(=O)Nc1ccc(NC(N)=O)cc1
InChIInChI=1S/C11H16N4O2/c12-7-1-2-10(16)14-8-3-5-9(6-4-8)15-11(13)17/h3-6H,1-2,7,12H2,(H,14,16)(H3,13,15,17)
InChIKeyPWULYNGCPLZGFM-UHFFFAOYSA-N
XLogP0.85
TPSA110.24 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 50.85
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-[4-(carbamoylamino)phenyl]hexanamide
CID 43711108
4-amino-N-(4-aminophenyl)butanamide
CID 90105668
4-amino-N-[4-(propanoylamino)phenyl]butanamide;hydrochloride
CID 119296184
4-amino-N-[4-(methylcarbamoylamino)phenyl]butanamide
CID 43710929
4-amino-N-(4-ethylsulfonylphenyl)butanamide
CID 43704501
5-amino-N-[4-(carbamoylamino)phenyl]hexanamide
CID 82848160
4-(6-aminohexanoylamino)benzamide
CID 24702559
4-amino-N-(4-methylsulfanylphenyl)butanamide;hydrochloride
CID 119273782
4-amino-N-[4-(prop-2-enylcarbamoylamino)phenyl]butanamide
CID 119278038
4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide
CID 43711207
7-amino-N-[4-[(carbamoylamino)methyl]phenyl]heptanamide;hydrochloride
CID 119757592
7-amino-N-(4-bromophenyl)heptanamide;hydrochloride
CID 119670334

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[4-(carbamoylamino)phenyl]butanamide?
The IUPAC name of 4-amino-N-[4-(carbamoylamino)phenyl]butanamide (CID 43711123) is 4-amino-N-[4-(carbamoylamino)phenyl]butanamide.
What is the SMILES notation for 4-amino-N-[4-(carbamoylamino)phenyl]butanamide?
The canonical SMILES for 4-amino-N-[4-(carbamoylamino)phenyl]butanamide is NCCCC(=O)Nc1ccc(NC(N)=O)cc1.
What is the InChIKey of 4-amino-N-[4-(carbamoylamino)phenyl]butanamide?
The InChIKey is PWULYNGCPLZGFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c12-7-1-2-10(16)14-8-3-5-9(6-4-8)15-11(13)17/h3-6H,1-2,7,12H2,(H,14,16)(H3,13,15,17).
What are the key properties of 4-amino-N-[4-(carbamoylamino)phenyl]butanamide?
4-amino-N-[4-(carbamoylamino)phenyl]butanamide has a molecular weight of 236.28 g/mol, XLogP of 0.85, 5 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[4-(carbamoylamino)phenyl]butanamide is sourced from PubChem (CID 43711123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).