5-amino-N-[4-(carbamoylamino)phenyl]hexanamide

C13H20N4O2 — CID 82848160

IUPAC5-amino-N-[4-(carbamoylamino)phenyl]hexanamide
SMILESCC(N)CCCC(=O)Nc1ccc(NC(N)=O)cc1
InChIInChI=1S/C13H20N4O2/c1-9(14)3-2-4-12(18)16-10-5-7-11(8-6-10)17-13(15)19/h5-9H,2-4,14H2,1H3,(H,16,18)(H3,15,17,19)
InChIKeyVHWPUMSSRLYJHZ-UHFFFAOYSA-N
MW264.33 g/mol
LogP1.63
Rot. Bonds6

About 5-amino-N-[4-(carbamoylamino)phenyl]hexanamide

5-amino-N-[4-(carbamoylamino)phenyl]hexanamide (PubChem CID 82848160) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 5-amino-N-[4-(carbamoylamino)phenyl]hexanamide.

Molecular Properties

Compound Name5-amino-N-[4-(carbamoylamino)phenyl]hexanamide
PubChem CID82848160
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name5-amino-N-[4-(carbamoylamino)phenyl]hexanamide
SMILESCC(N)CCCC(=O)Nc1ccc(NC(N)=O)cc1
InChIInChI=1S/C13H20N4O2/c1-9(14)3-2-4-12(18)16-10-5-7-11(8-6-10)17-13(15)19/h5-9H,2-4,14H2,1H3,(H,16,18)(H3,15,17,19)
InChIKeyVHWPUMSSRLYJHZ-UHFFFAOYSA-N
XLogP1.63
TPSA110.24 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.63
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N-(4-bromophenyl)hexanamide
CID 82848125
5-amino-N-(4-fluorophenyl)hexanamide
CID 82848209
N-(4-acetylphenyl)-5-aminohexanamide
CID 82852023
4-(5-aminohexanoylamino)-N-propan-2-ylbenzamide
CID 82849341
5-amino-N-(3,4-difluorophenyl)hexanamide
CID 82848790
5-amino-N-[4-(trifluoromethoxy)phenyl]hexanamide
CID 82848288
3-amino-N-[4-(carbamoylamino)phenyl]butanamide;hydrochloride
CID 119701459
4-amino-N-[4-(carbamoylamino)phenyl]butanamide
CID 43711123
5-amino-N-(4-pyrazol-1-ylphenyl)hexanamide
CID 82848976
5-amino-N-[4-(5-oxo-1,2-dihydropyrazol-3-yl)phenyl]hexanamide
CID 82850765
5-amino-N-(3-chlorophenyl)hexanamide
CID 82849187
5-amino-N-[3-(2-methylpropanoylamino)phenyl]hexanamide
CID 82850255

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[4-(carbamoylamino)phenyl]hexanamide?
The IUPAC name of 5-amino-N-[4-(carbamoylamino)phenyl]hexanamide (CID 82848160) is 5-amino-N-[4-(carbamoylamino)phenyl]hexanamide.
What is the SMILES notation for 5-amino-N-[4-(carbamoylamino)phenyl]hexanamide?
The canonical SMILES for 5-amino-N-[4-(carbamoylamino)phenyl]hexanamide is CC(N)CCCC(=O)Nc1ccc(NC(N)=O)cc1.
What is the InChIKey of 5-amino-N-[4-(carbamoylamino)phenyl]hexanamide?
The InChIKey is VHWPUMSSRLYJHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-9(14)3-2-4-12(18)16-10-5-7-11(8-6-10)17-13(15)19/h5-9H,2-4,14H2,1H3,(H,16,18)(H3,15,17,19).
What are the key properties of 5-amino-N-[4-(carbamoylamino)phenyl]hexanamide?
5-amino-N-[4-(carbamoylamino)phenyl]hexanamide has a molecular weight of 264.33 g/mol, XLogP of 1.63, 6 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[4-(carbamoylamino)phenyl]hexanamide is sourced from PubChem (CID 82848160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).