2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine

C14H28N2O — CID 63973844

IUPAC2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine
SMILESCOCC1CCN(C2CCCCCC2N)CC1
InChIInChI=1S/C14H28N2O/c1-17-11-12-7-9-16(10-8-12)14-6-4-2-3-5-13(14)15/h12-14H,2-11,15H2,1H3
InChIKeyCTJJFXMBFXXTMX-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.00
Rot. Bonds3

About 2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine

2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine (PubChem CID 63973844) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine.

Molecular Properties

Compound Name2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine
PubChem CID63973844
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine
SMILESCOCC1CCN(C2CCCCCC2N)CC1
InChIInChI=1S/C14H28N2O/c1-17-11-12-7-9-16(10-8-12)14-6-4-2-3-5-13(14)15/h12-14H,2-11,15H2,1H3
InChIKeyCTJJFXMBFXXTMX-UHFFFAOYSA-N
XLogP2.00
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(methoxymethyl)piperidin-1-yl]-N-methylcyclooctan-1-amine
CID 63971324
2-(4-methoxypiperidin-1-yl)cyclododecan-1-amine
CID 43372793
2-[4-(methoxymethyl)piperidin-1-yl]cycloheptane-1-carbonitrile
CID 63973853
2-[4-[(dimethylamino)methyl]piperidin-1-yl]cyclohexan-1-amine
CID 54985776
N-[[1-(2-aminocycloheptyl)piperidin-4-yl]methyl]acetamide
CID 102736897
2-[4-(methoxymethyl)piperidin-1-yl]-N-propylcycloheptan-1-amine
CID 63972305
1-cyclopentyl-4-(methoxymethyl)piperidine;ethane
CID 156885673
4-[4-(methoxymethyl)piperidin-1-yl]cyclohexan-1-amine
CID 63973090
1-cyclobutyl-4-(methoxymethyl)piperidine
CID 131107152
2-(4-methylpiperazin-1-yl)cyclododecan-1-amine
CID 16790088
2-[4-(cyclopropylmethyl)piperazin-1-yl]cycloheptan-1-amine
CID 61441275
2-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]cyclohexan-1-amine
CID 64582780

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine?
The IUPAC name of 2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine (CID 63973844) is 2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine.
What is the SMILES notation for 2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine?
The canonical SMILES for 2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine is COCC1CCN(C2CCCCCC2N)CC1.
What is the InChIKey of 2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine?
The InChIKey is CTJJFXMBFXXTMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-17-11-12-7-9-16(10-8-12)14-6-4-2-3-5-13(14)15/h12-14H,2-11,15H2,1H3.
What are the key properties of 2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine?
2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine has a molecular weight of 240.39 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methoxymethyl)piperidin-1-yl]cycloheptan-1-amine is sourced from PubChem (CID 63973844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).