5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine

C14H30N2O — CID 65253844

IUPAC5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine
SMILESCOCC1CCN(CCCC(C)(C)CN)CC1
InChIInChI=1S/C14H30N2O/c1-14(2,12-15)7-4-8-16-9-5-13(6-10-16)11-17-3/h13H,4-12,15H2,1-3H3
InChIKeyYRIIKVMKJNLMFT-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.11
Rot. Bonds7

About 5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine

5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine (PubChem CID 65253844) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine.

Molecular Properties

Compound Name5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine
PubChem CID65253844
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine
SMILESCOCC1CCN(CCCC(C)(C)CN)CC1
InChIInChI=1S/C14H30N2O/c1-14(2,12-15)7-4-8-16-9-5-13(6-10-16)11-17-3/h13H,4-12,15H2,1-3H3
InChIKeyYRIIKVMKJNLMFT-UHFFFAOYSA-N
XLogP2.11
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine?
The IUPAC name of 5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine (CID 65253844) is 5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine.
What is the SMILES notation for 5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine?
The canonical SMILES for 5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine is COCC1CCN(CCCC(C)(C)CN)CC1.
What is the InChIKey of 5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine?
The InChIKey is YRIIKVMKJNLMFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-14(2,12-15)7-4-8-16-9-5-13(6-10-16)11-17-3/h13H,4-12,15H2,1-3H3.
What are the key properties of 5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine?
5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 2.11, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(methoxymethyl)piperidin-1-yl]-2,2-dimethylpentan-1-amine is sourced from PubChem (CID 65253844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).