N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide

C12H24N2O2 — CID 62328076

IUPACN-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide
SMILESCCCC(C)NC(=O)C(C)OC1CCNC1
InChIInChI=1S/C12H24N2O2/c1-4-5-9(2)14-12(15)10(3)16-11-6-7-13-8-11/h9-11,13H,4-8H2,1-3H3,(H,14,15)
InChIKeyVUFLUFGQCJTSAB-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.06
Rot. Bonds6

About N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide

N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide (PubChem CID 62328076) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide.

Molecular Properties

Compound NameN-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide
PubChem CID62328076
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide
SMILESCCCC(C)NC(=O)C(C)OC1CCNC1
InChIInChI=1S/C12H24N2O2/c1-4-5-9(2)14-12(15)10(3)16-11-6-7-13-8-11/h9-11,13H,4-8H2,1-3H3,(H,14,15)
InChIKeyVUFLUFGQCJTSAB-UHFFFAOYSA-N
XLogP1.06
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-piperidin-3-yloxypropanamide
CID 43117602
N-pentyl-2-pyrrolidin-3-yloxypropanamide
CID 62327735
2-pyrrolidin-3-yloxypropanamide
CID 62327738
N-(2-methoxyethyl)-2-pyrrolidin-3-yloxypropanamide
CID 62327217
2-[(3S)-piperidin-3-yl]oxy-N-propylpropanamide
CID 66245011
2-(morpholin-2-ylmethoxy)-N-pentan-2-ylpropanamide
CID 114468630
N-(2-methylbutan-2-yl)-2-piperidin-3-yloxypropanamide
CID 43117590
2-(4-methylpiperidin-3-yl)oxy-N-propan-2-ylpropanamide
CID 102954272
N-pentan-2-ylpiperidine-3-carboxamide
CID 18072818
N-propan-2-yl-2-(pyrrolidin-3-ylmethoxy)propanamide
CID 62372806
N-(methylcarbamoyl)-2-[(3S)-piperidin-3-yl]oxypropanamide
CID 106938610
2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide
CID 106636671

Frequently Asked Questions

What is the IUPAC name of N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide?
The IUPAC name of N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide (CID 62328076) is N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide.
What is the SMILES notation for N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide?
The canonical SMILES for N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide is CCCC(C)NC(=O)C(C)OC1CCNC1.
What is the InChIKey of N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide?
The InChIKey is VUFLUFGQCJTSAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-5-9(2)14-12(15)10(3)16-11-6-7-13-8-11/h9-11,13H,4-8H2,1-3H3,(H,14,15).
What are the key properties of N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide?
N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide has a molecular weight of 228.34 g/mol, XLogP of 1.06, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-2-yl-2-pyrrolidin-3-yloxypropanamide is sourced from PubChem (CID 62328076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).