2-(2-cyclopropylpyrrolidin-1-yl)acetamide

C9H16N2O — CID 126996638

IUPAC2-(2-cyclopropylpyrrolidin-1-yl)acetamide
SMILESNC(=O)CN1CCCC1C1CC1
InChIInChI=1S/C9H16N2O/c10-9(12)6-11-5-1-2-8(11)7-3-4-7/h7-8H,1-6H2,(H2,10,12)
InChIKeyWHMSHWARXBKVSC-UHFFFAOYSA-N
MW168.24 g/mol
LogP0.35
Rot. Bonds3

About 2-(2-cyclopropylpyrrolidin-1-yl)acetamide

2-(2-cyclopropylpyrrolidin-1-yl)acetamide (PubChem CID 126996638) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is 2-(2-cyclopropylpyrrolidin-1-yl)acetamide.

Molecular Properties

Compound Name2-(2-cyclopropylpyrrolidin-1-yl)acetamide
PubChem CID126996638
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC Name2-(2-cyclopropylpyrrolidin-1-yl)acetamide
SMILESNC(=O)CN1CCCC1C1CC1
InChIInChI=1S/C9H16N2O/c10-9(12)6-11-5-1-2-8(11)7-3-4-7/h7-8H,1-6H2,(H2,10,12)
InChIKeyWHMSHWARXBKVSC-UHFFFAOYSA-N
XLogP0.35
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylpyrrolidin-1-yl)acetamide?
The IUPAC name of 2-(2-cyclopropylpyrrolidin-1-yl)acetamide (CID 126996638) is 2-(2-cyclopropylpyrrolidin-1-yl)acetamide.
What is the SMILES notation for 2-(2-cyclopropylpyrrolidin-1-yl)acetamide?
The canonical SMILES for 2-(2-cyclopropylpyrrolidin-1-yl)acetamide is NC(=O)CN1CCCC1C1CC1.
What is the InChIKey of 2-(2-cyclopropylpyrrolidin-1-yl)acetamide?
The InChIKey is WHMSHWARXBKVSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c10-9(12)6-11-5-1-2-8(11)7-3-4-7/h7-8H,1-6H2,(H2,10,12).
What are the key properties of 2-(2-cyclopropylpyrrolidin-1-yl)acetamide?
2-(2-cyclopropylpyrrolidin-1-yl)acetamide has a molecular weight of 168.24 g/mol, XLogP of 0.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylpyrrolidin-1-yl)acetamide is sourced from PubChem (CID 126996638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).