N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide

C12H26N2O2 — CID 112701446

IUPACN-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide
SMILESCC(C)CC(C)(CN)NC(=O)COC(C)C
InChIInChI=1S/C12H26N2O2/c1-9(2)6-12(5,8-13)14-11(15)7-16-10(3)4/h9-10H,6-8,13H2,1-5H3,(H,14,15)
InChIKeyOBKWUQAGHBLYQN-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.29
Rot. Bonds7

About N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide

N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide (PubChem CID 112701446) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide
PubChem CID112701446
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide
SMILESCC(C)CC(C)(CN)NC(=O)COC(C)C
InChIInChI=1S/C12H26N2O2/c1-9(2)6-12(5,8-13)14-11(15)7-16-10(3)4/h9-10H,6-8,13H2,1-5H3,(H,14,15)
InChIKeyOBKWUQAGHBLYQN-UHFFFAOYSA-N
XLogP1.29
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide?
The IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide (CID 112701446) is N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide?
The canonical SMILES for N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide is CC(C)CC(C)(CN)NC(=O)COC(C)C.
What is the InChIKey of N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide?
The InChIKey is OBKWUQAGHBLYQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-9(2)6-12(5,8-13)14-11(15)7-16-10(3)4/h9-10H,6-8,13H2,1-5H3,(H,14,15).
What are the key properties of N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide?
N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide has a molecular weight of 230.35 g/mol, XLogP of 1.29, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,4-dimethylpentan-2-yl)-2-propan-2-yloxyacetamide is sourced from PubChem (CID 112701446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).