(3S)-3-(ethoxymethyl)piperidine

C8H17NO — CID 42427180

IUPAC(3S)-3-(ethoxymethyl)piperidine
SMILESCCOC[C@H]1CCCNC1
InChIInChI=1S/C8H17NO/c1-2-10-7-8-4-3-5-9-6-8/h8-9H,2-7H2,1H3/t8-/m0/s1
InChIKeyHOSUXBKDVIAMEG-QMMMGPOBSA-N
MW143.23 g/mol
LogP1.02
Rot. Bonds3

About (3S)-3-(ethoxymethyl)piperidine

(3S)-3-(ethoxymethyl)piperidine (PubChem CID 42427180) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (3S)-3-(ethoxymethyl)piperidine.

Molecular Properties

Compound Name(3S)-3-(ethoxymethyl)piperidine
PubChem CID42427180
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(3S)-3-(ethoxymethyl)piperidine
SMILESCCOC[C@H]1CCCNC1
InChIInChI=1S/C8H17NO/c1-2-10-7-8-4-3-5-9-6-8/h8-9H,2-7H2,1H3/t8-/m0/s1
InChIKeyHOSUXBKDVIAMEG-QMMMGPOBSA-N
XLogP1.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-3-(ethoxymethyl)piperidine
CID 42427178
3-(ethoxymethyl)piperidine;hydrochloride
CID 17178071
3-(cyclopropylmethoxymethoxymethyl)piperidine
CID 106937752
1-(piperidin-3-ylmethoxy)butan-2-ol
CID 106939364
3-(2-ethoxyethoxymethyl)pyrrolidine;hydrochloride
CID 56829885
(3R)-3-(3-methylbutoxymethyl)piperidine
CID 26190551
3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride
CID 56829882
1-(piperidin-3-ylmethoxy)propan-2-ol
CID 106937756
3-(but-2-enoxymethyl)piperidine
CID 76940393
2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol
CID 106939384
3-(2-methylpentoxymethyl)piperidine
CID 62339734
3-(oxan-4-ylmethoxymethyl)piperidine
CID 62383187

Frequently Asked Questions

What is the IUPAC name of (3S)-3-(ethoxymethyl)piperidine?
The IUPAC name of (3S)-3-(ethoxymethyl)piperidine (CID 42427180) is (3S)-3-(ethoxymethyl)piperidine.
What is the SMILES notation for (3S)-3-(ethoxymethyl)piperidine?
The canonical SMILES for (3S)-3-(ethoxymethyl)piperidine is CCOC[C@H]1CCCNC1.
What is the InChIKey of (3S)-3-(ethoxymethyl)piperidine?
The InChIKey is HOSUXBKDVIAMEG-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H17NO/c1-2-10-7-8-4-3-5-9-6-8/h8-9H,2-7H2,1H3/t8-/m0/s1.
What are the key properties of (3S)-3-(ethoxymethyl)piperidine?
(3S)-3-(ethoxymethyl)piperidine has a molecular weight of 143.23 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-(ethoxymethyl)piperidine is sourced from PubChem (CID 42427180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).