N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide

C13H24N2O4 — CID 106101306

IUPACN-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide
SMILESO=C(CCOC1CCNCC1)NCC1(O)CCOC1
InChIInChI=1S/C13H24N2O4/c16-12(15-9-13(17)4-8-18-10-13)3-7-19-11-1-5-14-6-2-11/h11,14,17H,1-10H2,(H,15,16)
InChIKeyVYNCQILYXUYVSX-UHFFFAOYSA-N
MW272.34 g/mol
LogP-0.59
Rot. Bonds6

About N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide

N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide (PubChem CID 106101306) has the molecular formula C13H24N2O4 and a molecular weight of 272.34 g/mol. Its IUPAC name is N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide.

Molecular Properties

Compound NameN-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide
PubChem CID106101306
Molecular FormulaC13H24N2O4
Molecular Weight272.34 g/mol
Exact Mass272.17
IUPAC NameN-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide
SMILESO=C(CCOC1CCNCC1)NCC1(O)CCOC1
InChIInChI=1S/C13H24N2O4/c16-12(15-9-13(17)4-8-18-10-13)3-7-19-11-1-5-14-6-2-11/h11,14,17H,1-10H2,(H,15,16)
InChIKeyVYNCQILYXUYVSX-UHFFFAOYSA-N
XLogP-0.59
TPSA79.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.34
LogP ≤ 5-0.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-piperidin-4-yloxy-N-[(1-propylcyclopropyl)methyl]propanamide
CID 103920742
N-[(3-hydroxyoxolan-3-yl)methyl]-3-propoxypropanamide
CID 106102852
N-(2-amino-2-oxoethyl)-3-piperidin-4-yloxypropanamide
CID 63875429
5-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]pentanamide
CID 106103197
2-cyclobutyl-N-[(3-hydroxyoxolan-3-yl)methyl]acetamide
CID 103849320
3-piperidin-4-yloxy-N-prop-2-enylpropanamide
CID 63875272
2-chloro-N-[(3-hydroxyoxolan-3-yl)methyl]acetamide
CID 106765719
2-cyclohexyl-N-[(3-hydroxyoxolan-3-yl)methyl]acetamide
CID 103849536
2-methyl-N-[2-(3-piperidin-4-yloxypropanoylamino)ethyl]propanamide
CID 63904487
3-amino-3-cyclopropyl-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide
CID 106101542
N-(2,3-dimethylbutyl)-3-piperidin-4-yloxypropanamide
CID 64599298
N-[(4-hydroxyoxan-4-yl)methyl]-2-pyrrolidin-3-ylacetamide
CID 81130731

Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide?
The IUPAC name of N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide (CID 106101306) is N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide.
What is the SMILES notation for N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide?
The canonical SMILES for N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide is O=C(CCOC1CCNCC1)NCC1(O)CCOC1.
What is the InChIKey of N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide?
The InChIKey is VYNCQILYXUYVSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O4/c16-12(15-9-13(17)4-8-18-10-13)3-7-19-11-1-5-14-6-2-11/h11,14,17H,1-10H2,(H,15,16).
What are the key properties of N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide?
N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide has a molecular weight of 272.34 g/mol, XLogP of -0.59, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hydroxyoxolan-3-yl)methyl]-3-piperidin-4-yloxypropanamide is sourced from PubChem (CID 106101306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).