6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide

C15H33N3O2 — CID 63008631

IUPAC6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide
SMILESCCCNC(C)(CCCCN(C)CCCOC)C(N)=O
InChIInChI=1S/C15H33N3O2/c1-5-10-17-15(2,14(16)19)9-6-7-11-18(3)12-8-13-20-4/h17H,5-13H2,1-4H3,(H2,16,19)
InChIKeyCDRPDHUPSUSAAF-UHFFFAOYSA-N
MW287.45 g/mol
LogP1.37
Rot. Bonds13

About 6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide

6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide (PubChem CID 63008631) has the molecular formula C15H33N3O2 and a molecular weight of 287.45 g/mol. Its IUPAC name is 6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide.

Molecular Properties

Compound Name6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide
PubChem CID63008631
Molecular FormulaC15H33N3O2
Molecular Weight287.45 g/mol
Exact Mass287.26
IUPAC Name6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide
SMILESCCCNC(C)(CCCCN(C)CCCOC)C(N)=O
InChIInChI=1S/C15H33N3O2/c1-5-10-17-15(2,14(16)19)9-6-7-11-18(3)12-8-13-20-4/h17H,5-13H2,1-4H3,(H2,16,19)
InChIKeyCDRPDHUPSUSAAF-UHFFFAOYSA-N
XLogP1.37
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-[3-methoxypropyl(methyl)amino]-2-methyl-2-(methylamino)pentanamide
CID 63007906
6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanenitrile
CID 63007904
2-methyl-5-[methyl(2-pyrrolidin-1-ylethyl)amino]-2-(propylamino)pentanamide
CID 63210817
4-[2-methoxyethyl(methyl)amino]-2-methyl-2-(propylamino)pentanamide
CID 64710690
3-(3-methoxypropylsulfanyl)-2-methyl-2-(propylamino)propanamide
CID 63856340
3-[3-(dimethylamino)propyl-methylamino]-2-methyl-2-(propylamino)propanamide
CID 55226009
5-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide
CID 106666735
2-ethyl-5-[3-methoxypropyl(methyl)amino]-2-(propylamino)pentan-1-ol
CID 106808842
6-[3-methoxypropyl(methyl)amino]-2,2-dimethylhexanoic acid
CID 106714036
2-(ethylamino)-6-[2-(2-methoxyethoxy)ethoxy]-2-methylhexanamide
CID 104565452
2-methyl-2-(propylamino)-6-(1,1,1-trifluoropropan-2-yloxy)hexanamide
CID 66275068
5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide
CID 103191019

Frequently Asked Questions

What is the IUPAC name of 6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide?
The IUPAC name of 6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide (CID 63008631) is 6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide.
What is the SMILES notation for 6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide?
The canonical SMILES for 6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide is CCCNC(C)(CCCCN(C)CCCOC)C(N)=O.
What is the InChIKey of 6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide?
The InChIKey is CDRPDHUPSUSAAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3O2/c1-5-10-17-15(2,14(16)19)9-6-7-11-18(3)12-8-13-20-4/h17H,5-13H2,1-4H3,(H2,16,19).
What are the key properties of 6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide?
6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide has a molecular weight of 287.45 g/mol, XLogP of 1.37, 13 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-methoxypropyl(methyl)amino]-2-methyl-2-(propylamino)hexanamide is sourced from PubChem (CID 63008631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).