4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide

C15H32N2O3 — CID 106666691

IUPAC4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide
SMILESCCCNC(C)(CC(C)OCCC(C)(C)OC)C(N)=O
InChIInChI=1S/C15H32N2O3/c1-7-9-17-15(5,13(16)18)11-12(2)20-10-8-14(3,4)19-6/h12,17H,7-11H2,1-6H3,(H2,16,18)
InChIKeyQVEMWAUZBQQGKL-UHFFFAOYSA-N
MW288.43 g/mol
LogP1.84
Rot. Bonds11

About 4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide

4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide (PubChem CID 106666691) has the molecular formula C15H32N2O3 and a molecular weight of 288.43 g/mol. Its IUPAC name is 4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide.

Molecular Properties

Compound Name4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide
PubChem CID106666691
Molecular FormulaC15H32N2O3
Molecular Weight288.43 g/mol
Exact Mass288.24
IUPAC Name4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide
SMILESCCCNC(C)(CC(C)OCCC(C)(C)OC)C(N)=O
InChIInChI=1S/C15H32N2O3/c1-7-9-17-15(5,13(16)18)11-12(2)20-10-8-14(3,4)19-6/h12,17H,7-11H2,1-6H3,(H2,16,18)
InChIKeyQVEMWAUZBQQGKL-UHFFFAOYSA-N
XLogP1.84
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-4-pentan-2-yloxy-2-(propylamino)butanamide
CID 102984400
2-(ethylamino)-2-methyl-4-propoxypentanamide
CID 64708736
2-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(propylamino)pentanamide
CID 64709010
5-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide
CID 106666735
methyl 2-methyl-4-(2-propan-2-yloxyethoxy)-2-(propylamino)pentanoate
CID 64705937
2-methyl-2-(propylamino)-4-(3,3,3-trifluoropropoxy)pentanoic acid
CID 82959471
ethyl 2-methyl-2-(propylamino)-4-(3,3,3-trifluoropropoxy)pentanoate
CID 82962855
methyl 4-(2,2-difluoroethoxy)-2-methyl-2-(propylamino)pentanoate
CID 82005665
4-[2-methoxyethyl(methyl)amino]-2-methyl-2-(propylamino)pentanamide
CID 64710690
2-methyl-4-(2-propoxyethoxy)-2-(propylamino)pentanoic acid
CID 64720042
4-(2-methoxyethoxy)-2-methyl-2-(methylamino)pentanamide
CID 64707377
2-methyl-4-propan-2-ylsulfanyl-2-(propylamino)pentanamide
CID 64709561

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide?
The IUPAC name of 4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide (CID 106666691) is 4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide.
What is the SMILES notation for 4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide?
The canonical SMILES for 4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide is CCCNC(C)(CC(C)OCCC(C)(C)OC)C(N)=O.
What is the InChIKey of 4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide?
The InChIKey is QVEMWAUZBQQGKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O3/c1-7-9-17-15(5,13(16)18)11-12(2)20-10-8-14(3,4)19-6/h12,17H,7-11H2,1-6H3,(H2,16,18).
What are the key properties of 4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide?
4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide has a molecular weight of 288.43 g/mol, XLogP of 1.84, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide is sourced from PubChem (CID 106666691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).