(2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide

C10H20N2O3 — CID 104901176

IUPAC(2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide
SMILESCOC(OC)C(C)NC(=O)[C@H]1CCCN1
InChIInChI=1S/C10H20N2O3/c1-7(10(14-2)15-3)12-9(13)8-5-4-6-11-8/h7-8,10-11H,4-6H2,1-3H3,(H,12,13)/t7?,8-/m1/s1
InChIKeyQAMPKNCIXXVIJM-BRFYHDHCSA-N
MW216.28 g/mol
LogP-0.14
Rot. Bonds5

About (2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide

(2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide (PubChem CID 104901176) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is (2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide
PubChem CID104901176
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name(2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide
SMILESCOC(OC)C(C)NC(=O)[C@H]1CCCN1
InChIInChI=1S/C10H20N2O3/c1-7(10(14-2)15-3)12-9(13)8-5-4-6-11-8/h7-8,10-11H,4-6H2,1-3H3,(H,12,13)/t7?,8-/m1/s1
InChIKeyQAMPKNCIXXVIJM-BRFYHDHCSA-N
XLogP-0.14
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-propan-2-ylpyrrolidine-2-carboxamide;hydrochloride
CID 139022811
N-[(1R)-1-hydroxyethyl]pyrrolidine-2-carboxamide
CID 175256598
methyl 2-(pyrrolidine-2-carbonylamino)propanoate;hydrochloride
CID 119291009
(2R)-N-(3-hydroxybutan-2-yl)piperidine-2-carboxamide
CID 130934408
N-(3-methylpentan-2-yl)azepane-2-carboxamide
CID 64564622
methyl (3R,4R)-4-hydroxy-3-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoate
CID 71251216
(2S)-N-(1-amino-1-oxopropan-2-yl)pyrrolidine-2-carboxamide
CID 61155752
(2S)-N-[(1S)-1-cyclopentylethyl]pyrrolidine-2-carboxamide
CID 81388860
(2R)-N-propan-2-ylazetidine-2-carboxamide
CID 128886462
methyl 3-methyl-2-(pyrrolidine-2-carbonylamino)pentanoate
CID 14278857
(2S)-N-[1-(methylamino)-1-oxopropan-2-yl]pyrrolidine-2-carboxamide
CID 61467430
(2R)-N-(3-methylbutan-2-yl)azetidine-2-carboxamide;hydrochloride
CID 130636662

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide (CID 104901176) is (2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide is COC(OC)C(C)NC(=O)[C@H]1CCCN1.
What is the InChIKey of (2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide?
The InChIKey is QAMPKNCIXXVIJM-BRFYHDHCSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-7(10(14-2)15-3)12-9(13)8-5-4-6-11-8/h7-8,10-11H,4-6H2,1-3H3,(H,12,13)/t7?,8-/m1/s1.
What are the key properties of (2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide?
(2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide has a molecular weight of 216.28 g/mol, XLogP of -0.14, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(1,1-dimethoxypropan-2-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 104901176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).