2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide

C12H22N2O2 — CID 103977080

IUPAC2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide
SMILESCC(NC(=O)CC1CCCO1)C1CCNC1
InChIInChI=1S/C12H22N2O2/c1-9(10-4-5-13-8-10)14-12(15)7-11-3-2-6-16-11/h9-11,13H,2-8H2,1H3,(H,14,15)
InChIKeyFSIKLYULDXMRBX-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.67
Rot. Bonds4

About 2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide

2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide (PubChem CID 103977080) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide.

Molecular Properties

Compound Name2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide
PubChem CID103977080
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide
SMILESCC(NC(=O)CC1CCCO1)C1CCNC1
InChIInChI=1S/C12H22N2O2/c1-9(10-4-5-13-8-10)14-12(15)7-11-3-2-6-16-11/h9-11,13H,2-8H2,1H3,(H,14,15)
InChIKeyFSIKLYULDXMRBX-UHFFFAOYSA-N
XLogP0.67
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 ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(oxolan-2-yl)-N-(1-piperidin-4-ylethyl)propanamide
CID 65154890
2-cyclobutyl-N-(1-piperidin-3-ylethyl)acetamide
CID 103806063
2-cycloheptyl-N-(1-piperidin-3-ylethyl)acetamide
CID 115736930
N-(3-methylpiperidin-4-yl)-2-(oxolan-2-yl)acetamide;hydrochloride
CID 120556841
N-(1-piperidin-3-ylethyl)oxolane-2-carboxamide;hydrochloride
CID 119260228
(2S,3S)-3-methyl-2-[[2-(oxolan-2-yl)acetyl]amino]pentanoic acid
CID 65157376
N-[(4-methylpiperidin-3-yl)methyl]-2-(oxolan-2-yl)acetamide
CID 114955706
N-(1-pyrrolidin-3-ylethyl)oxane-4-carboxamide
CID 103977188
N-(1-pyrrolidin-3-ylethyl)morpholine-4-carboxamide
CID 103977253
N-(1-pyrrolidin-3-ylethyl)azepane-1-carboxamide
CID 113360894
N-(1-chloro-4-methylpentan-2-yl)-2-(oxolan-2-yl)acetamide
CID 114300771
N-(1-amino-1-hydroxyiminopropan-2-yl)-2-(oxolan-2-yl)acetamide
CID 77057681

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide?
The IUPAC name of 2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide (CID 103977080) is 2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide.
What is the SMILES notation for 2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide?
The canonical SMILES for 2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide is CC(NC(=O)CC1CCCO1)C1CCNC1.
What is the InChIKey of 2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide?
The InChIKey is FSIKLYULDXMRBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-9(10-4-5-13-8-10)14-12(15)7-11-3-2-6-16-11/h9-11,13H,2-8H2,1H3,(H,14,15).
What are the key properties of 2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide?
2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide has a molecular weight of 226.32 g/mol, XLogP of 0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-yl)-N-(1-pyrrolidin-3-ylethyl)acetamide is sourced from PubChem (CID 103977080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).