N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide

C20H30N2O3 — CID 97081899

IUPACN-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide
SMILESO=C(CC1(N2CCOCC2)CCCC1)NC[C@@H](O)Cc1ccccc1
InChIInChI=1S/C20H30N2O3/c23-18(14-17-6-2-1-3-7-17)16-21-19(24)15-20(8-4-5-9-20)22-10-12-25-13-11-22/h1-3,6-7,18,23H,4-5,8-16H2,(H,21,24)/t18-/m0/s1
InChIKeyFMNGAAYZXBABBB-SFHVURJKSA-N
MW346.47 g/mol
LogP1.74
Rot. Bonds7

About N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide

N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide (PubChem CID 97081899) has the molecular formula C20H30N2O3 and a molecular weight of 346.47 g/mol. Its IUPAC name is N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide.

Molecular Properties

Compound NameN-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide
PubChem CID97081899
Molecular FormulaC20H30N2O3
Molecular Weight346.47 g/mol
Exact Mass346.23
IUPAC NameN-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide
SMILESO=C(CC1(N2CCOCC2)CCCC1)NC[C@@H](O)Cc1ccccc1
InChIInChI=1S/C20H30N2O3/c23-18(14-17-6-2-1-3-7-17)16-21-19(24)15-20(8-4-5-9-20)22-10-12-25-13-11-22/h1-3,6-7,18,23H,4-5,8-16H2,(H,21,24)/t18-/m0/s1
InChIKeyFMNGAAYZXBABBB-SFHVURJKSA-N
XLogP1.74
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide?
The IUPAC name of N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide (CID 97081899) is N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide.
What is the SMILES notation for N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide?
The canonical SMILES for N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide is O=C(CC1(N2CCOCC2)CCCC1)NC[C@@H](O)Cc1ccccc1.
What is the InChIKey of N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide?
The InChIKey is FMNGAAYZXBABBB-SFHVURJKSA-N. The full InChI is InChI=1S/C20H30N2O3/c23-18(14-17-6-2-1-3-7-17)16-21-19(24)15-20(8-4-5-9-20)22-10-12-25-13-11-22/h1-3,6-7,18,23H,4-5,8-16H2,(H,21,24)/t18-/m0/s1.
What are the key properties of N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide?
N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide has a molecular weight of 346.47 g/mol, XLogP of 1.74, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide is sourced from PubChem (CID 97081899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).