N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide

C13H24N2O2 — CID 112686924

IUPACN-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide
SMILESCC(C)OCC(=O)NCC1CCN(C2CC2)C1
InChIInChI=1S/C13H24N2O2/c1-10(2)17-9-13(16)14-7-11-5-6-15(8-11)12-3-4-12/h10-12H,3-9H2,1-2H3,(H,14,16)
InChIKeyFHJKUFKACHAHEN-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.01
Rot. Bonds6

About N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide

N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide (PubChem CID 112686924) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide
PubChem CID112686924
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide
SMILESCC(C)OCC(=O)NCC1CCN(C2CC2)C1
InChIInChI=1S/C13H24N2O2/c1-10(2)17-9-13(16)14-7-11-5-6-15(8-11)12-3-4-12/h10-12H,3-9H2,1-2H3,(H,14,16)
InChIKeyFHJKUFKACHAHEN-UHFFFAOYSA-N
XLogP1.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-oxobutanamide
CID 60975912
N-[(1-tert-butylpiperidin-4-yl)methyl]-2-propan-2-yloxyacetamide
CID 176795528
3-[(1-cyclopropylpyrrolidin-3-yl)methylamino]-3-oxopropanoic acid
CID 62231885
2-chloro-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]acetamide
CID 60809819
(2R)-2-amino-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-methylbutanamide
CID 79013040
N-[(1-cyclopentylpyrrolidin-3-yl)methyl]-2-methoxyacetamide;formic acid
CID 154907735
4-[(1-cyclopropylpyrrolidin-3-yl)methylamino]-2-methyl-4-oxo-2-propan-2-ylbutanoic acid
CID 60856813
6-[(1-cyclopropylpyrrolidin-3-yl)methylamino]-6-oxohexanoic acid
CID 60856961
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-4-(methylamino)butanamide
CID 60859292
5-[(1-cyclopropylpyrrolidin-3-yl)methylamino]-5-oxopentanoic acid
CID 54927021
N-[[(3S)-1-cyclopentylpyrrolidin-3-yl]methyl]-3-methoxypropanamide
CID 125446366
2-amino-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]pentanamide;dihydrochloride
CID 119854796

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide?
The IUPAC name of N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide (CID 112686924) is N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide?
The canonical SMILES for N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide is CC(C)OCC(=O)NCC1CCN(C2CC2)C1.
What is the InChIKey of N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide?
The InChIKey is FHJKUFKACHAHEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-10(2)17-9-13(16)14-7-11-5-6-15(8-11)12-3-4-12/h10-12H,3-9H2,1-2H3,(H,14,16).
What are the key properties of N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide?
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide has a molecular weight of 240.35 g/mol, XLogP of 1.01, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-propan-2-yloxyacetamide is sourced from PubChem (CID 112686924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).