N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine

C13H28N2O — CID 65366916

IUPACN-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine
SMILESCCOCN1CCCCC1CNC(C)(C)C
InChIInChI=1S/C13H28N2O/c1-5-16-11-15-9-7-6-8-12(15)10-14-13(2,3)4/h12,14H,5-11H2,1-4H3
InChIKeyBRJDMPSNDVGBQN-UHFFFAOYSA-N
MW228.38 g/mol
LogP2.22
Rot. Bonds5

About N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine

N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine (PubChem CID 65366916) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine
PubChem CID65366916
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC NameN-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine
SMILESCCOCN1CCCCC1CNC(C)(C)C
InChIInChI=1S/C13H28N2O/c1-5-16-11-15-9-7-6-8-12(15)10-14-13(2,3)4/h12,14H,5-11H2,1-4H3
InChIKeyBRJDMPSNDVGBQN-UHFFFAOYSA-N
XLogP2.22
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(ethoxymethyl)piperidin-2-yl]-N-methylmethanamine
CID 65366865
2-methyl-N-[[1-(2-methylbutyl)piperidin-2-yl]methyl]propan-2-amine
CID 62580952
2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide
CID 63849748
2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N-ethyl-N-methylacetamide
CID 55256274
2-methyl-N-[[1-(2-morpholin-4-ylethyl)piperidin-2-yl]methyl]propan-2-amine
CID 62581128
N-[[1-(3,3-dimethylbutyl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine
CID 62581816
2-methyl-N-[[1-(2-methylbutyl)pyrrolidin-2-yl]methyl]propan-2-amine
CID 62580562
N-[(1-cyclopentylpiperidin-2-yl)methyl]-2-methylpropan-2-amine
CID 63849757
2-methyl-N-[[1-(2-phenoxyethyl)piperidin-2-yl]methyl]propan-2-amine
CID 62580601
N-[(1-ethylpiperidin-2-yl)methyl]-1,1,1-trifluoromethanamine
CID 71635319
1-[1-(cyclopropylmethoxymethyl)piperidin-2-yl]-N-methylmethanamine
CID 106931143
N-tert-butyl-2,2-dimethyl-3-(2-propylpiperidin-1-yl)propan-1-amine
CID 83061844

Frequently Asked Questions

What is the IUPAC name of N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine (CID 65366916) is N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine is CCOCN1CCCCC1CNC(C)(C)C.
What is the InChIKey of N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is BRJDMPSNDVGBQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-5-16-11-15-9-7-6-8-12(15)10-14-13(2,3)4/h12,14H,5-11H2,1-4H3.
What are the key properties of N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine?
N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 228.38 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 65366916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).