3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide

C12H26N2O2 — CID 115715312

IUPAC3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide
SMILESCCCCC(COC)NCCC(=O)N(C)C
InChIInChI=1S/C12H26N2O2/c1-5-6-7-11(10-16-4)13-9-8-12(15)14(2)3/h11,13H,5-10H2,1-4H3
InChIKeyCWPJSIOQIMHCED-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.26
Rot. Bonds9

About 3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide

3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide (PubChem CID 115715312) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide
PubChem CID115715312
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide
SMILESCCCCC(COC)NCCC(=O)N(C)C
InChIInChI=1S/C12H26N2O2/c1-5-6-7-11(10-16-4)13-9-8-12(15)14(2)3/h11,13H,5-10H2,1-4H3
InChIKeyCWPJSIOQIMHCED-UHFFFAOYSA-N
XLogP1.26
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-methoxyhexan-2-ylamino)-N-methylpropanamide
CID 115712706
1-methoxy-N-[2-(2-methoxyethoxy)ethyl]hexan-2-amine
CID 115712453
1-methoxy-N-(4-methoxybutyl)hexan-2-amine
CID 115709746
2-(1-methoxyhexan-2-ylamino)-N-methylacetamide
CID 115706822
1-methoxy-N-(2-methylsulfinylethyl)hexan-2-amine
CID 115720755
2-[2-(1-methoxyhexan-2-ylamino)ethoxy]ethanol
CID 115707263
3-butoxy-N,N-dimethylpropanamide;3-methoxy-N,N-dimethylpropanamide
CID 141458250
N,N-dimethyl-3-(3-methylpentan-2-ylamino)propanamide
CID 60925489
(2S)-1-methoxy-N-methylhexan-2-amine
CID 177242292
methyl 2-[[3-(diethylamino)-3-oxopropyl]amino]hexanoate
CID 103868418
N-(2-cyclobutylethyl)-1-methoxyhexan-2-amine
CID 115893443
N-ethyl-1-methoxydecan-2-amine
CID 62320563

Frequently Asked Questions

What is the IUPAC name of 3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide?
The IUPAC name of 3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide (CID 115715312) is 3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide.
What is the SMILES notation for 3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide?
The canonical SMILES for 3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide is CCCCC(COC)NCCC(=O)N(C)C.
What is the InChIKey of 3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide?
The InChIKey is CWPJSIOQIMHCED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-5-6-7-11(10-16-4)13-9-8-12(15)14(2)3/h11,13H,5-10H2,1-4H3.
What are the key properties of 3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide?
3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide has a molecular weight of 230.35 g/mol, XLogP of 1.26, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methoxyhexan-2-ylamino)-N,N-dimethylpropanamide is sourced from PubChem (CID 115715312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).