1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine

C13H28N2O — CID 106623955

IUPAC1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine
SMILESCOCC(C)N(CC1CCCNC1)C(C)C
InChIInChI=1S/C13H28N2O/c1-11(2)15(12(3)10-16-4)9-13-6-5-7-14-8-13/h11-14H,5-10H2,1-4H3
InChIKeySSVNRJBGKPEKLM-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.73
Rot. Bonds6

About 1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine

1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine (PubChem CID 106623955) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound Name1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine
PubChem CID106623955
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine
SMILESCOCC(C)N(CC1CCCNC1)C(C)C
InChIInChI=1S/C13H28N2O/c1-11(2)15(12(3)10-16-4)9-13-6-5-7-14-8-13/h11-14H,5-10H2,1-4H3
InChIKeySSVNRJBGKPEKLM-UHFFFAOYSA-N
XLogP1.73
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methoxy-N-methyl-N-(piperidin-3-ylmethyl)propan-2-amine
CID 61452791
1-methoxy-3-[methyl(piperidin-3-ylmethyl)amino]propan-2-ol
CID 80554421
2-methyl-1-phenyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-1-amine
CID 106623958
2-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-1-amine
CID 103815885
N-[1-(2-methylphenyl)ethyl]-N-(piperidin-3-ylmethyl)propan-2-amine
CID 106624032
3-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-1-sulfonamide
CID 106630987
N-(cycloheptylmethyl)-N-(piperidin-3-ylmethyl)propan-2-amine
CID 106624258
1-(4-fluorophenyl)-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-1-amine
CID 106623943
N-(2-methylbutan-2-yl)-2-[piperidin-3-ylmethyl(propan-2-yl)amino]propanamide
CID 106637456
2-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-1-amine;hydrochloride
CID 119930509
N-ethyl-3-methoxy-N-(piperidin-3-ylmethyl)propanamide
CID 106629400
N-(piperidin-3-ylmethyl)-N-[2-(trifluoromethoxy)ethyl]propan-2-amine
CID 106637776

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine?
The IUPAC name of 1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine (CID 106623955) is 1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for 1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine?
The canonical SMILES for 1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine is COCC(C)N(CC1CCCNC1)C(C)C.
What is the InChIKey of 1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine?
The InChIKey is SSVNRJBGKPEKLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-11(2)15(12(3)10-16-4)9-13-6-5-7-14-8-13/h11-14H,5-10H2,1-4H3.
What are the key properties of 1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine?
1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine has a molecular weight of 228.38 g/mol, XLogP of 1.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 106623955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).