N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide

C12H22N2O2 — CID 114761731

IUPACN-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide
SMILESCC1(CNC(=O)CC2CCCO2)CCCN1
InChIInChI=1S/C12H22N2O2/c1-12(5-3-6-14-12)9-13-11(15)8-10-4-2-7-16-10/h10,14H,2-9H2,1H3,(H,13,15)
InChIKeyUAFNBDTTWHUKAA-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.81
Rot. Bonds4

About N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide

N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide (PubChem CID 114761731) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide.

Molecular Properties

Compound NameN-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide
PubChem CID114761731
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide
SMILESCC1(CNC(=O)CC2CCCO2)CCCN1
InChIInChI=1S/C12H22N2O2/c1-12(5-3-6-14-12)9-13-11(15)8-10-4-2-7-16-10/h10,14H,2-9H2,1H3,(H,13,15)
InChIKeyUAFNBDTTWHUKAA-UHFFFAOYSA-N
XLogP0.81
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(aminomethyl)cyclopentyl]methyl]-2-(oxolan-2-yl)acetamide
CID 113295133
N-[[1-(chloromethyl)cyclohexyl]methyl]-2-(oxolan-2-yl)acetamide
CID 113359953
N-[(2-methylpiperidin-2-yl)methyl]-1-(oxan-2-yl)methanamine
CID 104594958
2-(oxolan-2-yl)-N-(oxolan-2-ylmethyl)acetamide
CID 110696563
N-(2-acetamidoethyl)-2-(oxolan-2-yl)acetamide
CID 110696614
2-(oxolan-2-yl)-N-prop-2-ynylacetamide
CID 60769102
N-[(2-methylpyrrolidin-2-yl)methyl]hexanamide
CID 114761896
4-methyl-1-[[[2-(oxan-2-yl)acetyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 115440948
N-(2-methylprop-2-enyl)-2-(oxolan-2-yl)acetamide
CID 114618448
N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide
CID 110696561
N-[(2-methylpyrrolidin-2-yl)methyl]prop-2-ynamide
CID 130542642
N-(3-chloro-2,2-dimethylpropyl)-2-(oxolan-2-yl)acetamide
CID 115364529

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide?
The IUPAC name of N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide (CID 114761731) is N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide.
What is the SMILES notation for N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide?
The canonical SMILES for N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide is CC1(CNC(=O)CC2CCCO2)CCCN1.
What is the InChIKey of N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide?
The InChIKey is UAFNBDTTWHUKAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-12(5-3-6-14-12)9-13-11(15)8-10-4-2-7-16-10/h10,14H,2-9H2,1H3,(H,13,15).
What are the key properties of N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide?
N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide has a molecular weight of 226.32 g/mol, XLogP of 0.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpyrrolidin-2-yl)methyl]-2-(oxolan-2-yl)acetamide is sourced from PubChem (CID 114761731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).