N-methyl-3-pyrrolidin-1-ylpropanamide

C8H16N2O — CID 20700879

IUPACN-methyl-3-pyrrolidin-1-ylpropanamide
SMILESCNC(=O)CCN1CCCC1
InChIInChI=1S/C8H16N2O/c1-9-8(11)4-7-10-5-2-3-6-10/h2-7H2,1H3,(H,9,11)
InChIKeyDTRYSUUFZDUXMV-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.22
Rot. Bonds3

About N-methyl-3-pyrrolidin-1-ylpropanamide

N-methyl-3-pyrrolidin-1-ylpropanamide (PubChem CID 20700879) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N-methyl-3-pyrrolidin-1-ylpropanamide.

Molecular Properties

Compound NameN-methyl-3-pyrrolidin-1-ylpropanamide
PubChem CID20700879
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN-methyl-3-pyrrolidin-1-ylpropanamide
SMILESCNC(=O)CCN1CCCC1
InChIInChI=1S/C8H16N2O/c1-9-8(11)4-7-10-5-2-3-6-10/h2-7H2,1H3,(H,9,11)
InChIKeyDTRYSUUFZDUXMV-UHFFFAOYSA-N
XLogP0.22
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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3-[3-(hydroxymethyl)piperidin-1-yl]-N-methylpropanamide
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3-(3-hydroxyazetidin-1-yl)-N-methylpropanamide
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4-[4-(5-aminopentyl)-1,4-diazepan-1-yl]-N-methylbutanamide
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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-pyrrolidin-1-ylpropanamide?
The IUPAC name of N-methyl-3-pyrrolidin-1-ylpropanamide (CID 20700879) is N-methyl-3-pyrrolidin-1-ylpropanamide.
What is the SMILES notation for N-methyl-3-pyrrolidin-1-ylpropanamide?
The canonical SMILES for N-methyl-3-pyrrolidin-1-ylpropanamide is CNC(=O)CCN1CCCC1.
What is the InChIKey of N-methyl-3-pyrrolidin-1-ylpropanamide?
The InChIKey is DTRYSUUFZDUXMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-9-8(11)4-7-10-5-2-3-6-10/h2-7H2,1H3,(H,9,11).
What are the key properties of N-methyl-3-pyrrolidin-1-ylpropanamide?
N-methyl-3-pyrrolidin-1-ylpropanamide has a molecular weight of 156.23 g/mol, XLogP of 0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-pyrrolidin-1-ylpropanamide is sourced from PubChem (CID 20700879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).