methanol;1-(methylaminomethyl)piperidin-4-amine

C8H21N3O — CID 143586103

IUPACmethanol;1-(methylaminomethyl)piperidin-4-amine
SMILESCNCN1CCC(N)CC1.CO
InChIInChI=1S/C7H17N3.CH4O/c1-9-6-10-4-2-7(8)3-5-10;1-2/h7,9H,2-6,8H2,1H3;2H,1H3
InChIKeyAUQAAWYRWTWCGG-UHFFFAOYSA-N
MW175.28 g/mol
LogP-0.81
Rot. Bonds2

About methanol;1-(methylaminomethyl)piperidin-4-amine

methanol;1-(methylaminomethyl)piperidin-4-amine (PubChem CID 143586103) has the molecular formula C8H21N3O and a molecular weight of 175.28 g/mol. Its IUPAC name is methanol;1-(methylaminomethyl)piperidin-4-amine.

Molecular Properties

Compound Namemethanol;1-(methylaminomethyl)piperidin-4-amine
PubChem CID143586103
Molecular FormulaC8H21N3O
Molecular Weight175.28 g/mol
Exact Mass175.17
IUPAC Namemethanol;1-(methylaminomethyl)piperidin-4-amine
SMILESCNCN1CCC(N)CC1.CO
InChIInChI=1S/C7H17N3.CH4O/c1-9-6-10-4-2-7(8)3-5-10;1-2/h7,9H,2-6,8H2,1H3;2H,1H3
InChIKeyAUQAAWYRWTWCGG-UHFFFAOYSA-N
XLogP-0.81
TPSA61.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.28
LogP ≤ 5-0.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methanol;1-(methylaminomethyl)piperidin-4-amine?
The IUPAC name of methanol;1-(methylaminomethyl)piperidin-4-amine (CID 143586103) is methanol;1-(methylaminomethyl)piperidin-4-amine.
What is the SMILES notation for methanol;1-(methylaminomethyl)piperidin-4-amine?
The canonical SMILES for methanol;1-(methylaminomethyl)piperidin-4-amine is CNCN1CCC(N)CC1.CO.
What is the InChIKey of methanol;1-(methylaminomethyl)piperidin-4-amine?
The InChIKey is AUQAAWYRWTWCGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3.CH4O/c1-9-6-10-4-2-7(8)3-5-10;1-2/h7,9H,2-6,8H2,1H3;2H,1H3.
What are the key properties of methanol;1-(methylaminomethyl)piperidin-4-amine?
methanol;1-(methylaminomethyl)piperidin-4-amine has a molecular weight of 175.28 g/mol, XLogP of -0.81, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;1-(methylaminomethyl)piperidin-4-amine is sourced from PubChem (CID 143586103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).