2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide

C14H28N2O3 — CID 75392163

IUPAC2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide
SMILESCOCC(O)CN(C)C(=O)C(C)N1C(C)CCC1C
InChIInChI=1S/C14H28N2O3/c1-10-6-7-11(2)16(10)12(3)14(18)15(4)8-13(17)9-19-5/h10-13,17H,6-9H2,1-5H3
InChIKeyCCPPLUNRWCBKGL-UHFFFAOYSA-N
MW272.39 g/mol
LogP0.71
Rot. Bonds6

About 2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide

2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide (PubChem CID 75392163) has the molecular formula C14H28N2O3 and a molecular weight of 272.39 g/mol. Its IUPAC name is 2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide.

Molecular Properties

Compound Name2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide
PubChem CID75392163
Molecular FormulaC14H28N2O3
Molecular Weight272.39 g/mol
Exact Mass272.21
IUPAC Name2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide
SMILESCOCC(O)CN(C)C(=O)C(C)N1C(C)CCC1C
InChIInChI=1S/C14H28N2O3/c1-10-6-7-11(2)16(10)12(3)14(18)15(4)8-13(17)9-19-5/h10-13,17H,6-9H2,1-5H3
InChIKeyCCPPLUNRWCBKGL-UHFFFAOYSA-N
XLogP0.71
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methoxy-N-methylpropanamide
CID 81089598
(2R)-2-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]-N-methyl-N-(3,3,3-trifluoropropyl)propanamide
CID 99108294
2-(2,5-dimethylpyrrolidin-1-yl)-N-methyl-N-(piperidin-4-ylmethyl)propanamide
CID 79720600
3,3,3-trifluoro-N-(2-hydroxy-3-methoxypropyl)-N-methyl-2-(trifluoromethyl)propanamide
CID 103310159
2-amino-N-(2-hydroxy-3-methoxypropyl)-N,3,3-trimethylbutanamide
CID 76911278
N-(2-hydroxy-3-methoxypropyl)-N-methylbut-2-ynamide
CID 106741532
3-amino-4-[(2-hydroxy-3-methoxypropyl)-methylamino]-4-oxobutanoic acid
CID 64895957
1-acetyl-N-(2-hydroxy-3-methoxypropyl)-N-methylpiperidine-3-carboxamide
CID 54993733
N-(2-hydroxy-3-methoxypropyl)-N-methyloxane-2-carboxamide
CID 62213191
N-(2-amino-1-cyclopropylethyl)-2-(2,5-dimethylpyrrolidin-1-yl)-N-methylpropanamide
CID 116652027
2-acetamido-N-(2-hydroxy-3-methoxypropyl)-N-methyl-3-sulfanylpropanamide
CID 107769331
N-(2-hydroxy-3-methoxypropyl)-N-methyl-2-(3-methylpiperidin-2-yl)acetamide
CID 107147698

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide?
The IUPAC name of 2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide (CID 75392163) is 2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide.
What is the SMILES notation for 2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide?
The canonical SMILES for 2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide is COCC(O)CN(C)C(=O)C(C)N1C(C)CCC1C.
What is the InChIKey of 2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide?
The InChIKey is CCPPLUNRWCBKGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O3/c1-10-6-7-11(2)16(10)12(3)14(18)15(4)8-13(17)9-19-5/h10-13,17H,6-9H2,1-5H3.
What are the key properties of 2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide?
2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide has a molecular weight of 272.39 g/mol, XLogP of 0.71, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpyrrolidin-1-yl)-N-(2-hydroxy-3-methoxypropyl)-N-methylpropanamide is sourced from PubChem (CID 75392163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).