N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide

C16H31N3O2 — CID 63903373

IUPACN-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide
SMILESCN(CCNC(=O)CCOC1CCNCC1)C1CCCC1
InChIInChI=1S/C16H31N3O2/c1-19(14-4-2-3-5-14)12-11-18-16(20)8-13-21-15-6-9-17-10-7-15/h14-15,17H,2-13H2,1H3,(H,18,20)
InChIKeyXKUONAPSUTXUPI-UHFFFAOYSA-N
MW297.44 g/mol
LogP1.14
Rot. Bonds8

About N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide

N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide (PubChem CID 63903373) has the molecular formula C16H31N3O2 and a molecular weight of 297.44 g/mol. Its IUPAC name is N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide.

Molecular Properties

Compound NameN-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide
PubChem CID63903373
Molecular FormulaC16H31N3O2
Molecular Weight297.44 g/mol
Exact Mass297.24
IUPAC NameN-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide
SMILESCN(CCNC(=O)CCOC1CCNCC1)C1CCCC1
InChIInChI=1S/C16H31N3O2/c1-19(14-4-2-3-5-14)12-11-18-16(20)8-13-21-15-6-9-17-10-7-15/h14-15,17H,2-13H2,1H3,(H,18,20)
InChIKeyXKUONAPSUTXUPI-UHFFFAOYSA-N
XLogP1.14
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.44
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide?
The IUPAC name of N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide (CID 63903373) is N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide.
What is the SMILES notation for N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide?
The canonical SMILES for N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide is CN(CCNC(=O)CCOC1CCNCC1)C1CCCC1.
What is the InChIKey of N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide?
The InChIKey is XKUONAPSUTXUPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O2/c1-19(14-4-2-3-5-14)12-11-18-16(20)8-13-21-15-6-9-17-10-7-15/h14-15,17H,2-13H2,1H3,(H,18,20).
What are the key properties of N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide?
N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide has a molecular weight of 297.44 g/mol, XLogP of 1.14, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclopentyl(methyl)amino]ethyl]-3-piperidin-4-yloxypropanamide is sourced from PubChem (CID 63903373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).