3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide

C21H38N2O2 — CID 42346355

IUPAC3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide
SMILESO=C(CCC1CCN(CCCC2CCCC2)CC1)NC[C@H]1CCCO1
InChIInChI=1S/C21H38N2O2/c24-21(22-17-20-8-4-16-25-20)10-9-19-11-14-23(15-12-19)13-3-7-18-5-1-2-6-18/h18-20H,1-17H2,(H,22,24)/t20-/m1/s1
InChIKeyHCPZEBDSJZQLFL-HXUWFJFHSA-N
MW350.55 g/mol
LogP3.74
Rot. Bonds9

About 3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide

3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide (PubChem CID 42346355) has the molecular formula C21H38N2O2 and a molecular weight of 350.55 g/mol. Its IUPAC name is 3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide.

Molecular Properties

Compound Name3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide
PubChem CID42346355
Molecular FormulaC21H38N2O2
Molecular Weight350.55 g/mol
Exact Mass350.29
IUPAC Name3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide
SMILESO=C(CCC1CCN(CCCC2CCCC2)CC1)NC[C@H]1CCCO1
InChIInChI=1S/C21H38N2O2/c24-21(22-17-20-8-4-16-25-20)10-9-19-11-14-23(15-12-19)13-3-7-18-5-1-2-6-18/h18-20H,1-17H2,(H,22,24)/t20-/m1/s1
InChIKeyHCPZEBDSJZQLFL-HXUWFJFHSA-N
XLogP3.74
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.55
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide?
The IUPAC name of 3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide (CID 42346355) is 3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide.
What is the SMILES notation for 3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide?
The canonical SMILES for 3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide is O=C(CCC1CCN(CCCC2CCCC2)CC1)NC[C@H]1CCCO1.
What is the InChIKey of 3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide?
The InChIKey is HCPZEBDSJZQLFL-HXUWFJFHSA-N. The full InChI is InChI=1S/C21H38N2O2/c24-21(22-17-20-8-4-16-25-20)10-9-19-11-14-23(15-12-19)13-3-7-18-5-1-2-6-18/h18-20H,1-17H2,(H,22,24)/t20-/m1/s1.
What are the key properties of 3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide?
3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide has a molecular weight of 350.55 g/mol, XLogP of 3.74, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(3-cyclopentylpropyl)piperidin-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]propanamide is sourced from PubChem (CID 42346355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).