N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide

C11H23NO3 — CID 112692857

IUPACN-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide
SMILESCOCC(NC(=O)COC(C)C)C(C)C
InChIInChI=1S/C11H23NO3/c1-8(2)10(6-14-5)12-11(13)7-15-9(3)4/h8-10H,6-7H2,1-5H3,(H,12,13)
InChIKeyXZRLGRIMUOCWTD-UHFFFAOYSA-N
MW217.31 g/mol
LogP1.20
Rot. Bonds7

About N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide

N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide (PubChem CID 112692857) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide
PubChem CID112692857
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC NameN-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide
SMILESCOCC(NC(=O)COC(C)C)C(C)C
InChIInChI=1S/C11H23NO3/c1-8(2)10(6-14-5)12-11(13)7-15-9(3)4/h8-10H,6-7H2,1-5H3,(H,12,13)
InChIKeyXZRLGRIMUOCWTD-UHFFFAOYSA-N
XLogP1.20
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-(1-methoxy-3-methylbutan-2-yl)acetamide
CID 65053483
N-[(2S)-1-methoxy-3-methylbutan-2-yl]acetamide
CID 167034901
N-(1-methoxy-3-methylbutan-2-yl)acetamide
CID 65053654
3-methyl-2-[(2-propan-2-yloxyacetyl)amino]butanoic acid
CID 20799020
ethane;N-propan-2-yl-2-propan-2-yloxyacetamide
CID 167679831
5-hydroxy-N-(1-methoxy-3-methylbutan-2-yl)pentanamide
CID 79208953
N-(3,3-dimethylbutan-2-yl)-2-propan-2-yloxyacetamide
CID 115622733
2-amino-N-[2-[(1-methoxy-3-methylbutan-2-yl)amino]-2-oxoethyl]acetamide
CID 65049070
N-(1-hydroxy-3-methylbutan-2-yl)-2-(2-methoxyethoxy)acetamide
CID 79255861
N-(2-hydroxy-3-methoxypropyl)-2-propan-2-yloxyacetamide
CID 112703011
(2R)-2-[(1-methoxy-3-methylbutan-2-yl)carbamoylamino]-3-methylbutanoic acid
CID 79010313
2-(azetidin-3-yl)-N-(1-methoxy-3-methylbutan-2-yl)acetamide
CID 65049010

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide?
The IUPAC name of N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide (CID 112692857) is N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide?
The canonical SMILES for N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide is COCC(NC(=O)COC(C)C)C(C)C.
What is the InChIKey of N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide?
The InChIKey is XZRLGRIMUOCWTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-8(2)10(6-14-5)12-11(13)7-15-9(3)4/h8-10H,6-7H2,1-5H3,(H,12,13).
What are the key properties of N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide?
N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide has a molecular weight of 217.31 g/mol, XLogP of 1.20, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxy-3-methylbutan-2-yl)-2-propan-2-yloxyacetamide is sourced from PubChem (CID 112692857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).