2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide

C11H23N3O3 — CID 43500738

IUPAC2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide
SMILESCC(C)CC(NC(N)=O)C(=O)NC(C)(C)CO
InChIInChI=1S/C11H23N3O3/c1-7(2)5-8(13-10(12)17)9(16)14-11(3,4)6-15/h7-8,15H,5-6H2,1-4H3,(H,14,16)(H3,12,13,17)
InChIKeyCYGAMHFGMSOCQH-UHFFFAOYSA-N
MW245.32 g/mol
LogP-0.04
Rot. Bonds6

About 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide

2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide (PubChem CID 43500738) has the molecular formula C11H23N3O3 and a molecular weight of 245.32 g/mol. Its IUPAC name is 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide.

Molecular Properties

Compound Name2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide
PubChem CID43500738
Molecular FormulaC11H23N3O3
Molecular Weight245.32 g/mol
Exact Mass245.17
IUPAC Name2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide
SMILESCC(C)CC(NC(N)=O)C(=O)NC(C)(C)CO
InChIInChI=1S/C11H23N3O3/c1-7(2)5-8(13-10(12)17)9(16)14-11(3,4)6-15/h7-8,15H,5-6H2,1-4H3,(H,14,16)(H3,12,13,17)
InChIKeyCYGAMHFGMSOCQH-UHFFFAOYSA-N
XLogP-0.04
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 5-0.04
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide?
The IUPAC name of 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide (CID 43500738) is 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide.
What is the SMILES notation for 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide?
The canonical SMILES for 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide is CC(C)CC(NC(N)=O)C(=O)NC(C)(C)CO.
What is the InChIKey of 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide?
The InChIKey is CYGAMHFGMSOCQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3/c1-7(2)5-8(13-10(12)17)9(16)14-11(3,4)6-15/h7-8,15H,5-6H2,1-4H3,(H,14,16)(H3,12,13,17).
What are the key properties of 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide?
2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide has a molecular weight of 245.32 g/mol, XLogP of -0.04, 6 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbamoylamino)-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylpentanamide is sourced from PubChem (CID 43500738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).