(2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide

C12H24N2O2 — CID 103795441

IUPAC(2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
SMILESCCC(C)N(CCOC)C(=O)[C@H]1CCCN1
InChIInChI=1S/C12H24N2O2/c1-4-10(2)14(8-9-16-3)12(15)11-6-5-7-13-11/h10-11,13H,4-9H2,1-3H3/t10?,11-/m1/s1
InChIKeyQEWADUQWJWYKOU-RRKGBCIJSA-N
MW228.34 g/mol
LogP1.01
Rot. Bonds6

About (2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide

(2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide (PubChem CID 103795441) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is (2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
PubChem CID103795441
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name(2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
SMILESCCC(C)N(CCOC)C(=O)[C@H]1CCCN1
InChIInChI=1S/C12H24N2O2/c1-4-10(2)14(8-9-16-3)12(15)11-6-5-7-13-11/h10-11,13H,4-9H2,1-3H3/t10?,11-/m1/s1
InChIKeyQEWADUQWJWYKOU-RRKGBCIJSA-N
XLogP1.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-(2-methoxyethyl)-N-pentan-3-ylpyrrolidine-2-carboxamide
CID 61163560
(3R)-N-butan-2-yl-N-(2-methoxyethyl)piperidine-3-carboxamide
CID 81140494
(3S)-N-butan-2-yl-N-(2-methoxyethyl)piperidine-3-carboxamide
CID 81140319
(2S)-N-(2-methoxyethyl)-N-methylpyrrolidine-2-carboxamide;hydrochloride
CID 68805915
(2S)-N-propan-2-yl-N-propylpyrrolidine-2-carboxamide
CID 61156228
methyl 2-[propan-2-yl(pyrrolidine-2-carbonyl)amino]acetate
CID 60947765
2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid
CID 103869714
N-(2-methoxyethyl)-4-methyl-N-pentan-3-ylpiperidine-2-carboxamide
CID 114423422
(2R)-N-(3-methoxypropyl)-N-methylpyrrolidine-2-carboxamide
CID 94912304
(2R)-N-(2-hydroxyethyl)-N-propan-2-ylpyrrolidine-2-carboxamide
CID 93173809
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide
CID 55005047
(2R)-N-ethyl-N-(2-methylbutyl)pyrrolidine-2-carboxamide
CID 103797895

Frequently Asked Questions

What is the IUPAC name of (2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide (CID 103795441) is (2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide is CCC(C)N(CCOC)C(=O)[C@H]1CCCN1.
What is the InChIKey of (2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide?
The InChIKey is QEWADUQWJWYKOU-RRKGBCIJSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-10(2)14(8-9-16-3)12(15)11-6-5-7-13-11/h10-11,13H,4-9H2,1-3H3/t10?,11-/m1/s1.
What are the key properties of (2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide?
(2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide has a molecular weight of 228.34 g/mol, XLogP of 1.01, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 103795441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).