N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide

C15H28N2O3 — CID 75509294

IUPACN-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide
SMILESCC(O)CC1COCCN1C(=O)NCCC1CCCC1
InChIInChI=1S/C15H28N2O3/c1-12(18)10-14-11-20-9-8-17(14)15(19)16-7-6-13-4-2-3-5-13/h12-14,18H,2-11H2,1H3,(H,16,19)
InChIKeyBGZMYINXTKVNBC-UHFFFAOYSA-N
MW284.40 g/mol
LogP1.75
Rot. Bonds5

About N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide

N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide (PubChem CID 75509294) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide
PubChem CID75509294
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC NameN-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide
SMILESCC(O)CC1COCCN1C(=O)NCCC1CCCC1
InChIInChI=1S/C15H28N2O3/c1-12(18)10-14-11-20-9-8-17(14)15(19)16-7-6-13-4-2-3-5-13/h12-14,18H,2-11H2,1H3,(H,16,19)
InChIKeyBGZMYINXTKVNBC-UHFFFAOYSA-N
XLogP1.75
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide?
The IUPAC name of N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide (CID 75509294) is N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide?
The canonical SMILES for N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide is CC(O)CC1COCCN1C(=O)NCCC1CCCC1.
What is the InChIKey of N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide?
The InChIKey is BGZMYINXTKVNBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-12(18)10-14-11-20-9-8-17(14)15(19)16-7-6-13-4-2-3-5-13/h12-14,18H,2-11H2,1H3,(H,16,19).
What are the key properties of N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide?
N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide has a molecular weight of 284.40 g/mol, XLogP of 1.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide is sourced from PubChem (CID 75509294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).