2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone

C17H24N2O2 — CID 124987741

IUPAC2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone
SMILESCc1cc([C@H]2CN(C(=O)CC3CCCC3)CCO2)ccn1
InChIInChI=1S/C17H24N2O2/c1-13-10-15(6-7-18-13)16-12-19(8-9-21-16)17(20)11-14-4-2-3-5-14/h6-7,10,14,16H,2-5,8-9,11-12H2,1H3/t16-/m1/s1
InChIKeyOIFDRWWIUQJLHX-MRXNPFEDSA-N
MW288.39 g/mol
LogP2.87
Rot. Bonds3

About 2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone

2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone (PubChem CID 124987741) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone
PubChem CID124987741
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone
SMILESCc1cc([C@H]2CN(C(=O)CC3CCCC3)CCO2)ccn1
InChIInChI=1S/C17H24N2O2/c1-13-10-15(6-7-18-13)16-12-19(8-9-21-16)17(20)11-14-4-2-3-5-14/h6-7,10,14,16H,2-5,8-9,11-12H2,1H3/t16-/m1/s1
InChIKeyOIFDRWWIUQJLHX-MRXNPFEDSA-N
XLogP2.87
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone?
The IUPAC name of 2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone (CID 124987741) is 2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone.
What is the SMILES notation for 2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone?
The canonical SMILES for 2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone is Cc1cc([C@H]2CN(C(=O)CC3CCCC3)CCO2)ccn1.
What is the InChIKey of 2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone?
The InChIKey is OIFDRWWIUQJLHX-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-13-10-15(6-7-18-13)16-12-19(8-9-21-16)17(20)11-14-4-2-3-5-14/h6-7,10,14,16H,2-5,8-9,11-12H2,1H3/t16-/m1/s1.
What are the key properties of 2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone?
2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone has a molecular weight of 288.39 g/mol, XLogP of 2.87, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone is sourced from PubChem (CID 124987741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).