N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine

C14H30N2O — CID 106589290

IUPACN-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine
SMILESCOCC1CCCN(C(C)CNCC(C)C)C1
InChIInChI=1S/C14H30N2O/c1-12(2)8-15-9-13(3)16-7-5-6-14(10-16)11-17-4/h12-15H,5-11H2,1-4H3
InChIKeyOKFIDGOLIVKKPX-UHFFFAOYSA-N
MW242.41 g/mol
LogP1.98
Rot. Bonds7

About N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine

N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine (PubChem CID 106589290) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine
PubChem CID106589290
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC NameN-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine
SMILESCOCC1CCCN(C(C)CNCC(C)C)C1
InChIInChI=1S/C14H30N2O/c1-12(2)8-15-9-13(3)16-7-5-6-14(10-16)11-17-4/h12-15H,5-11H2,1-4H3
InChIKeyOKFIDGOLIVKKPX-UHFFFAOYSA-N
XLogP1.98
TPSA24.50 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 ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-ethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine
CID 62433783
(3S)-3-(methoxymethyl)-1-propan-2-ylpiperidine
CID 167395488
methanol;3-(methoxymethyl)-1-propan-2-ylpiperidine
CID 172576332
2-methyl-N-[2-(3-propoxypiperidin-1-yl)propyl]propan-1-amine
CID 62412248
2-(3-ethylpiperidin-1-yl)-N-propylpropan-1-amine
CID 62433605
N-ethyl-3-methoxy-2-[3-(methoxymethyl)piperidin-1-yl]propan-1-amine
CID 106589294
3-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 64582008
2-[3-(methoxymethyl)piperidin-1-yl]-N-methylbutan-1-amine
CID 106589339
N-[2-(4-methoxypiperidin-1-yl)propyl]-2-methylpropan-1-amine
CID 62420010
(2S)-2-[(3R)-3-(methoxymethyl)piperidin-1-yl]propanoic acid
CID 129413747
N-[2-(3-methoxypiperidin-1-yl)propyl]-3-methylbutan-1-amine
CID 102968396
3-(3-methoxypiperidin-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 102968159

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine?
The IUPAC name of N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine (CID 106589290) is N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine is COCC1CCCN(C(C)CNCC(C)C)C1.
What is the InChIKey of N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine?
The InChIKey is OKFIDGOLIVKKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-12(2)8-15-9-13(3)16-7-5-6-14(10-16)11-17-4/h12-15H,5-11H2,1-4H3.
What are the key properties of N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine?
N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 1.98, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(methoxymethyl)piperidin-1-yl]propyl]-2-methylpropan-1-amine is sourced from PubChem (CID 106589290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).