N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride

C16H26ClN3O2 — CID 175839939

IUPACN-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride
SMILESCc1cccnc1OCC(C)(C)NC(=O)CC1CCCN1.Cl
InChIInChI=1S/C16H25N3O2.ClH/c1-12-6-4-9-18-15(12)21-11-16(2,3)19-14(20)10-13-7-5-8-17-13;/h4,6,9,13,17H,5,7-8,10-11H2,1-3H3,(H,19,20);1H
InChIKeyOVIDPRSEFQWXCB-UHFFFAOYSA-N
MW327.86 g/mol
LogP2.23
Rot. Bonds6

About N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride

N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride (PubChem CID 175839939) has the molecular formula C16H26ClN3O2 and a molecular weight of 327.86 g/mol. Its IUPAC name is N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride
PubChem CID175839939
Molecular FormulaC16H26ClN3O2
Molecular Weight327.86 g/mol
Exact Mass327.17
IUPAC NameN-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride
SMILESCc1cccnc1OCC(C)(C)NC(=O)CC1CCCN1.Cl
InChIInChI=1S/C16H25N3O2.ClH/c1-12-6-4-9-18-15(12)21-11-16(2,3)19-14(20)10-13-7-5-8-17-13;/h4,6,9,13,17H,5,7-8,10-11H2,1-3H3,(H,19,20);1H
InChIKeyOVIDPRSEFQWXCB-UHFFFAOYSA-N
XLogP2.23
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.86
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-[(2R)-1-methylpyrrolidin-2-yl]acetamide
CID 166072035
(2R)-2-[2-[[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]amino]-2-oxoethyl]pyrrolidine-1-carboxylic acid
CID 166772595
2-pyrrolidin-2-yl-N-[[2-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]acetamide;dihydrochloride
CID 119847157
N-(2-methyl-3-pyridinyl)-2-pyrrolidin-2-ylacetamide;dihydrochloride
CID 119844533
N-(pyrrolidin-2-ylmethyl)-2-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;dihydrochloride
CID 119514467
N-[1-(4-bromophenyl)-2-methylpropan-2-yl]-2-pyrrolidin-2-ylacetamide
CID 119772728
N-(2-isoquinolin-1-ylpropan-2-yl)-2-[(2S)-pyrrolidin-2-yl]acetamide
CID 166072086
2-(1,5-dimethylpyrrolidin-2-yl)-N-[2-methoxy-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]acetamide
CID 168742136
N-(2,4-dimethyl-3-pyridinyl)-2-pyrrolidin-2-ylacetamide
CID 112741904
N-(2-methylpentan-2-yl)-2-pyrrolidin-2-ylacetamide
CID 115738895
N-[2-(2,6-dimethylphenoxy)ethyl]-2-pyrrolidin-2-ylacetamide
CID 119734952
N-[2-(3,4-dichlorophenyl)propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119758543

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride?
The IUPAC name of N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride (CID 175839939) is N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride.
What is the SMILES notation for N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride?
The canonical SMILES for N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride is Cc1cccnc1OCC(C)(C)NC(=O)CC1CCCN1.Cl.
What is the InChIKey of N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride?
The InChIKey is OVIDPRSEFQWXCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2.ClH/c1-12-6-4-9-18-15(12)21-11-16(2,3)19-14(20)10-13-7-5-8-17-13;/h4,6,9,13,17H,5,7-8,10-11H2,1-3H3,(H,19,20);1H.
What are the key properties of N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride?
N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride has a molecular weight of 327.86 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-1-[(3-methyl-2-pyridinyl)oxy]propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride is sourced from PubChem (CID 175839939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).