[1-(2-methylpropyl)piperidin-4-yl]methanamine

C10H22N2 — CID 22992230

IUPAC[1-(2-methylpropyl)piperidin-4-yl]methanamine
SMILESCC(C)CN1CCC(CN)CC1
InChIInChI=1S/C10H22N2/c1-9(2)8-12-5-3-10(7-11)4-6-12/h9-10H,3-8,11H2,1-2H3
InChIKeyPGTRGAHRESDWCZ-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.31
Rot. Bonds3

About [1-(2-methylpropyl)piperidin-4-yl]methanamine

[1-(2-methylpropyl)piperidin-4-yl]methanamine (PubChem CID 22992230) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is [1-(2-methylpropyl)piperidin-4-yl]methanamine.

Molecular Properties

Compound Name[1-(2-methylpropyl)piperidin-4-yl]methanamine
PubChem CID22992230
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name[1-(2-methylpropyl)piperidin-4-yl]methanamine
SMILESCC(C)CN1CCC(CN)CC1
InChIInChI=1S/C10H22N2/c1-9(2)8-12-5-3-10(7-11)4-6-12/h9-10H,3-8,11H2,1-2H3
InChIKeyPGTRGAHRESDWCZ-UHFFFAOYSA-N
XLogP1.31
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(2-methylpropyl)piperidin-4-yl]methanamine?
The IUPAC name of [1-(2-methylpropyl)piperidin-4-yl]methanamine (CID 22992230) is [1-(2-methylpropyl)piperidin-4-yl]methanamine.
What is the SMILES notation for [1-(2-methylpropyl)piperidin-4-yl]methanamine?
The canonical SMILES for [1-(2-methylpropyl)piperidin-4-yl]methanamine is CC(C)CN1CCC(CN)CC1.
What is the InChIKey of [1-(2-methylpropyl)piperidin-4-yl]methanamine?
The InChIKey is PGTRGAHRESDWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-9(2)8-12-5-3-10(7-11)4-6-12/h9-10H,3-8,11H2,1-2H3.
What are the key properties of [1-(2-methylpropyl)piperidin-4-yl]methanamine?
[1-(2-methylpropyl)piperidin-4-yl]methanamine has a molecular weight of 170.30 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methylpropyl)piperidin-4-yl]methanamine is sourced from PubChem (CID 22992230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).