N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide

C13H26N2O3 — CID 55166694

IUPACN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide
SMILESCOCCN(C(=O)C1(C)CCNC1)C(C)COC
InChIInChI=1S/C13H26N2O3/c1-11(9-18-4)15(7-8-17-3)12(16)13(2)5-6-14-10-13/h11,14H,5-10H2,1-4H3
InChIKeyIQNUINSGSGPJOF-UHFFFAOYSA-N
MW258.36 g/mol
LogP0.50
Rot. Bonds7

About N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide

N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide (PubChem CID 55166694) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide
PubChem CID55166694
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC NameN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide
SMILESCOCCN(C(=O)C1(C)CCNC1)C(C)COC
InChIInChI=1S/C13H26N2O3/c1-11(9-18-4)15(7-8-17-3)12(16)13(2)5-6-14-10-13/h11,14H,5-10H2,1-4H3
InChIKeyIQNUINSGSGPJOF-UHFFFAOYSA-N
XLogP0.50
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 63710773
N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide
CID 63143850
N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 63142401
N,N-bis(2-methoxyethyl)-3-methylpiperidine-3-carboxamide
CID 63130592
N-ethyl-N-(2-methoxyethyl)-3-methylpiperidine-3-carboxamide
CID 63135216
N,N-bis(2-methoxyethyl)-4-methylpiperidine-4-carboxamide
CID 55179285
1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutane-1-carboxamide
CID 80587697
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-piperidin-4-ylsulfanylacetamide
CID 114627353
N,3-dimethyl-N-(4-methylpentan-2-yl)pyrrolidine-3-carboxamide
CID 63143490
methyl 2-[(3-methylpyrrolidine-3-carbonyl)-propylamino]acetate
CID 63143757
N-(3-methoxypropyl)-3-methylpyrrolidine-3-carboxamide
CID 63138395
N-ethyl-N-(1-methoxypropan-2-yl)-2-methylpiperidine-2-carboxamide
CID 104596433

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide (CID 55166694) is N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide is COCCN(C(=O)C1(C)CCNC1)C(C)COC.
What is the InChIKey of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide?
The InChIKey is IQNUINSGSGPJOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-11(9-18-4)15(7-8-17-3)12(16)13(2)5-6-14-10-13/h11,14H,5-10H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide?
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide has a molecular weight of 258.36 g/mol, XLogP of 0.50, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 55166694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).