2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide

C13H28N2O2 — CID 102984400

IUPAC2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide
SMILESCCCNC(C)(CCOC(C)CCC)C(N)=O
InChIInChI=1S/C13H28N2O2/c1-5-7-11(3)17-10-8-13(4,12(14)16)15-9-6-2/h11,15H,5-10H2,1-4H3,(H2,14,16)
InChIKeyZPRSAAUODUXZBC-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.83
Rot. Bonds10

About 2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide

2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide (PubChem CID 102984400) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide.

Molecular Properties

Compound Name2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide
PubChem CID102984400
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide
SMILESCCCNC(C)(CCOC(C)CCC)C(N)=O
InChIInChI=1S/C13H28N2O2/c1-5-7-11(3)17-10-8-13(4,12(14)16)15-9-6-2/h11,15H,5-10H2,1-4H3,(H2,14,16)
InChIKeyZPRSAAUODUXZBC-UHFFFAOYSA-N
XLogP1.83
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide
CID 106666691
2-methyl-3-pentan-2-yloxy-2-(propylamino)propanoic acid
CID 102984225
2-methyl-2-(propylamino)-6-(1,1,1-trifluoropropan-2-yloxy)hexanamide
CID 66275068
2-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(propylamino)pentanamide
CID 64709010
2-methyl-6-(methylamino)-2-(propylamino)heptanediamide
CID 66221079
ethyl 2-methyl-2-(propylamino)-4-(3,3,3-trifluoropropoxy)pentanoate
CID 82962855
2-methyl-2-(propylamino)-4-(3,3,3-trifluoropropoxy)pentanoic acid
CID 82959471
2-pentan-2-yloxyethyl 3-oxobutanoate
CID 59193436
2-(ethylamino)-2-methyl-4-propoxypentanamide
CID 64708736
2,2-dimethyl-5-pentan-2-yloxypentanimidamide
CID 102982171
2-methyl-4-propan-2-ylsulfanyl-2-(propylamino)pentanamide
CID 64709561
2-(ethylamino)-2-methyl-5-(2-methylpentoxy)pentanamide
CID 103284877

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide?
The IUPAC name of 2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide (CID 102984400) is 2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide.
What is the SMILES notation for 2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide?
The canonical SMILES for 2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide is CCCNC(C)(CCOC(C)CCC)C(N)=O.
What is the InChIKey of 2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide?
The InChIKey is ZPRSAAUODUXZBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-5-7-11(3)17-10-8-13(4,12(14)16)15-9-6-2/h11,15H,5-10H2,1-4H3,(H2,14,16).
What are the key properties of 2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide?
2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide has a molecular weight of 244.38 g/mol, XLogP of 1.83, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide is sourced from PubChem (CID 102984400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).