4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine

C14H28N2O — CID 117271828

IUPAC4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine
SMILESCOCC1(C2CCN(C(C)C)CC2)CCCN1
InChIInChI=1S/C14H28N2O/c1-12(2)16-9-5-13(6-10-16)14(11-17-3)7-4-8-15-14/h12-13,15H,4-11H2,1-3H3
InChIKeyAEEATOKRVWZWQK-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.88
Rot. Bonds4

About 4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine

4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine (PubChem CID 117271828) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine
PubChem CID117271828
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine
SMILESCOCC1(C2CCN(C(C)C)CC2)CCCN1
InChIInChI=1S/C14H28N2O/c1-12(2)16-9-5-13(6-10-16)14(11-17-3)7-4-8-15-14/h12-13,15H,4-11H2,1-3H3
InChIKeyAEEATOKRVWZWQK-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(methoxymethyl)-2-piperidin-4-ylpiperidine
CID 117271970
3-[2-(methoxymethyl)pyrrolidin-2-yl]piperidine
CID 117271846
2-(methoxymethyl)-2-pyrrolidin-2-ylpiperidine
CID 117271998
[2-[(1-propan-2-ylpiperidin-4-yl)methyl]pyrrolidin-2-yl]methanol
CID 115103198
2-cyclopropyl-2-(2-methylbutyl)pyrrolidine
CID 66466256
2-(methoxymethyl)-2-(thiolan-2-yl)piperidine
CID 117271997
4-fluoro-4-(methoxymethyl)-1-propan-2-ylpiperidine
CID 167239675
[2-(1-methylpiperidin-4-yl)piperidin-2-yl]methanol
CID 115103505
2-cyclopentyl-2-propylpyrrolidine
CID 66466252
methyl 2-(1-propan-2-ylpiperidin-3-yl)pyrrolidine-2-carboxylate
CID 115103232
7a-ethyl-1,2,3,4,4a,5,6,7-octahydrocyclopenta[b]pyridine
CID 83680079
[2-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol
CID 115103178

Frequently Asked Questions

What is the IUPAC name of 4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine?
The IUPAC name of 4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine (CID 117271828) is 4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine.
What is the SMILES notation for 4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine?
The canonical SMILES for 4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine is COCC1(C2CCN(C(C)C)CC2)CCCN1.
What is the InChIKey of 4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine?
The InChIKey is AEEATOKRVWZWQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12(2)16-9-5-13(6-10-16)14(11-17-3)7-4-8-15-14/h12-13,15H,4-11H2,1-3H3.
What are the key properties of 4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine?
4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine has a molecular weight of 240.39 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(methoxymethyl)pyrrolidin-2-yl]-1-propan-2-ylpiperidine is sourced from PubChem (CID 117271828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).