4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide

C13H19N3O3 — CID 64555959

IUPAC4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide
SMILESCCC(C)(CO)NC(=O)c1ccc(NC(N)=O)cc1
InChIInChI=1S/C13H19N3O3/c1-3-13(2,8-17)16-11(18)9-4-6-10(7-5-9)15-12(14)19/h4-7,17H,3,8H2,1-2H3,(H,16,18)(H3,14,15,19)
InChIKeyDMXXDUAMNPANKT-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.07
Rot. Bonds5

About 4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide

4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide (PubChem CID 64555959) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide.

Molecular Properties

Compound Name4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide
PubChem CID64555959
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide
SMILESCCC(C)(CO)NC(=O)c1ccc(NC(N)=O)cc1
InChIInChI=1S/C13H19N3O3/c1-3-13(2,8-17)16-11(18)9-4-6-10(7-5-9)15-12(14)19/h4-7,17H,3,8H2,1-2H3,(H,16,18)(H3,14,15,19)
InChIKeyDMXXDUAMNPANKT-UHFFFAOYSA-N
XLogP1.07
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.07
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

4-(carbamoylamino)-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]benzamide
CID 107846638
4-(hydroxymethyl)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide
CID 64558344
4-(carbamoylamino)-N-(4-hydroxy-2-methylbutan-2-yl)benzamide
CID 115969000
N-(1-hydroxy-2-methylbutan-2-yl)-4-methoxybenzamide
CID 64557752
1-(4-tert-butylphenyl)-3-(1-hydroxy-2-methylbutan-2-yl)urea
CID 71924647
N-(1-hydroxy-2-methylbutan-2-yl)-4-(trifluoromethoxy)benzamide
CID 64555572
3-(carbamoylamino)-N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]benzamide
CID 99193425
4-[(Z)-N'-hydroxycarbamimidoyl]-N-(3-methylpentan-3-yl)benzamide
CID 106330933
3-amino-N-(1-hydroxy-2-methylbutan-2-yl)benzamide
CID 64549288
N-(1-hydroxy-2-methylbutan-2-yl)-3,5-dimethylbenzamide
CID 64558339
N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide
CID 64556207
4-[(2-aminoacetyl)amino]-N-(2-methylbutan-2-yl)benzamide
CID 119297460

Frequently Asked Questions

What is the IUPAC name of 4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide?
The IUPAC name of 4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide (CID 64555959) is 4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide.
What is the SMILES notation for 4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide?
The canonical SMILES for 4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide is CCC(C)(CO)NC(=O)c1ccc(NC(N)=O)cc1.
What is the InChIKey of 4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide?
The InChIKey is DMXXDUAMNPANKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-3-13(2,8-17)16-11(18)9-4-6-10(7-5-9)15-12(14)19/h4-7,17H,3,8H2,1-2H3,(H,16,18)(H3,14,15,19).
What are the key properties of 4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide?
4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide has a molecular weight of 265.31 g/mol, XLogP of 1.07, 5 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide is sourced from PubChem (CID 64555959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).