N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide

C11H22N2O2 — CID 115642604

IUPACN,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide
SMILESCCN(CC)C(=O)N1CCC(COC)C1
InChIInChI=1S/C11H22N2O2/c1-4-12(5-2)11(14)13-7-6-10(8-13)9-15-3/h10H,4-9H2,1-3H3
InChIKeyBIFHFFSGGLZWNV-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.42
Rot. Bonds4

About N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide

N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide (PubChem CID 115642604) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide
PubChem CID115642604
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide
SMILESCCN(CC)C(=O)N1CCC(COC)C1
InChIInChI=1S/C11H22N2O2/c1-4-12(5-2)11(14)13-7-6-10(8-13)9-15-3/h10H,4-9H2,1-3H3
InChIKeyBIFHFFSGGLZWNV-UHFFFAOYSA-N
XLogP1.42
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[3-(methoxymethyl)pyrrolidine-1-carbonyl]-methylamino]acetic acid
CID 64597214
3-(methoxymethyl)pyrrolidine-1-carboxylate
CID 131747487
2-[[3-(methoxymethyl)pyrrolidine-1-carbonyl]-propan-2-ylamino]acetic acid
CID 64598633
2-bromo-1-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methylpropan-1-one
CID 114328777
N,N-diethyl-3-hydroxy-4-methylpiperidine-1-carboxamide
CID 103896864
4-[(3S)-3-(methoxymethyl)pyrrolidin-1-yl]-4-oxobutanoic acid
CID 129370989
tert-butyl (3S)-3-(methoxymethyl)pyrrolidine-1-carboxylate
CID 86332594
1-(diethylcarbamoyl)pyrrolidine-3-sulfonic acid
CID 145259237
N-(2-chloroacetyl)-3-(methoxymethyl)pyrrolidine-1-carboxamide
CID 64596602
3-(aminomethyl)-N,N-diethylazetidine-1-carboxamide
CID 79160798
2-amino-1-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methylpropan-1-one;hydrochloride
CID 119322639
3-amino-1-[3-(methoxymethyl)pyrrolidin-1-yl]-2,2-dimethylpropan-1-one
CID 64569299

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide?
The IUPAC name of N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide (CID 115642604) is N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide is CCN(CC)C(=O)N1CCC(COC)C1.
What is the InChIKey of N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide?
The InChIKey is BIFHFFSGGLZWNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-4-12(5-2)11(14)13-7-6-10(8-13)9-15-3/h10H,4-9H2,1-3H3.
What are the key properties of N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide?
N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 1.42, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-(methoxymethyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 115642604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).