3-(2-methoxypropyl)-N,N'-dimethylpentanediamide

C11H22N2O3 — CID 141238561

IUPAC3-(2-methoxypropyl)-N,N'-dimethylpentanediamide
SMILESCNC(=O)CC(CC(=O)NC)CC(C)OC
InChIInChI=1S/C11H22N2O3/c1-8(16-4)5-9(6-10(14)12-2)7-11(15)13-3/h8-9H,5-7H2,1-4H3,(H,12,14)(H,13,15)
InChIKeyGAPBIMPGHKEOBU-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.30
Rot. Bonds7

About 3-(2-methoxypropyl)-N,N'-dimethylpentanediamide

3-(2-methoxypropyl)-N,N'-dimethylpentanediamide (PubChem CID 141238561) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-(2-methoxypropyl)-N,N'-dimethylpentanediamide.

Molecular Properties

Compound Name3-(2-methoxypropyl)-N,N'-dimethylpentanediamide
PubChem CID141238561
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name3-(2-methoxypropyl)-N,N'-dimethylpentanediamide
SMILESCNC(=O)CC(CC(=O)NC)CC(C)OC
InChIInChI=1S/C11H22N2O3/c1-8(16-4)5-9(6-10(14)12-2)7-11(15)13-3/h8-9H,5-7H2,1-4H3,(H,12,14)(H,13,15)
InChIKeyGAPBIMPGHKEOBU-UHFFFAOYSA-N
XLogP0.30
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;3-ethyl-N,5-dimethylhexanamide
CID 177048526
5-methoxy-3-methylhexanoic acid
CID 150312715
(3R)-3-amino-N-methylbutanamide;hydrochloride
CID 87931451
(4R)-4-methoxypentan-2-one
CID 10749159
(3S)-3-methoxybutanoic acid
CID 51374275
N-(1,3-dimethoxybutyl)acetamide
CID 22123473
ethane;3-hydroxy-N,5-dimethylhexanamide;vanadium
CID 177155626
(3S)-N-methyl-3-methylsulfanylbutanamide
CID 58528328
2-(3-methoxybutan-2-ylamino)-N-methylacetamide
CID 115706830
(2R,4S)-4-methoxypentan-2-ol
CID 59003340
(3R)-3-acetamido-N-methylbutanamide
CID 87931486
2-amino-4-methoxypentanoic acid
CID 21255646

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxypropyl)-N,N'-dimethylpentanediamide?
The IUPAC name of 3-(2-methoxypropyl)-N,N'-dimethylpentanediamide (CID 141238561) is 3-(2-methoxypropyl)-N,N'-dimethylpentanediamide.
What is the SMILES notation for 3-(2-methoxypropyl)-N,N'-dimethylpentanediamide?
The canonical SMILES for 3-(2-methoxypropyl)-N,N'-dimethylpentanediamide is CNC(=O)CC(CC(=O)NC)CC(C)OC.
What is the InChIKey of 3-(2-methoxypropyl)-N,N'-dimethylpentanediamide?
The InChIKey is GAPBIMPGHKEOBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-8(16-4)5-9(6-10(14)12-2)7-11(15)13-3/h8-9H,5-7H2,1-4H3,(H,12,14)(H,13,15).
What are the key properties of 3-(2-methoxypropyl)-N,N'-dimethylpentanediamide?
3-(2-methoxypropyl)-N,N'-dimethylpentanediamide has a molecular weight of 230.31 g/mol, XLogP of 0.30, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxypropyl)-N,N'-dimethylpentanediamide is sourced from PubChem (CID 141238561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).