(1-pyridin-4-ylpiperidin-4-yl)methanamine

C11H17N3 — CID 10607746

IUPAC(1-pyridin-4-ylpiperidin-4-yl)methanamine
SMILESNCC1CCN(c2ccncc2)CC1
InChIInChI=1S/C11H17N3/c12-9-10-3-7-14(8-4-10)11-1-5-13-6-2-11/h1-2,5-6,10H,3-4,7-9,12H2
InChIKeyJVTMDVFGRFFOOB-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.26
Rot. Bonds2

About (1-pyridin-4-ylpiperidin-4-yl)methanamine

(1-pyridin-4-ylpiperidin-4-yl)methanamine (PubChem CID 10607746) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is (1-pyridin-4-ylpiperidin-4-yl)methanamine.

Molecular Properties

Compound Name(1-pyridin-4-ylpiperidin-4-yl)methanamine
PubChem CID10607746
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name(1-pyridin-4-ylpiperidin-4-yl)methanamine
SMILESNCC1CCN(c2ccncc2)CC1
InChIInChI=1S/C11H17N3/c12-9-10-3-7-14(8-4-10)11-1-5-13-6-2-11/h1-2,5-6,10H,3-4,7-9,12H2
InChIKeyJVTMDVFGRFFOOB-UHFFFAOYSA-N
XLogP1.26
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-pyridin-4-ylpiperidin-4-yl)methanamine?
The IUPAC name of (1-pyridin-4-ylpiperidin-4-yl)methanamine (CID 10607746) is (1-pyridin-4-ylpiperidin-4-yl)methanamine.
What is the SMILES notation for (1-pyridin-4-ylpiperidin-4-yl)methanamine?
The canonical SMILES for (1-pyridin-4-ylpiperidin-4-yl)methanamine is NCC1CCN(c2ccncc2)CC1.
What is the InChIKey of (1-pyridin-4-ylpiperidin-4-yl)methanamine?
The InChIKey is JVTMDVFGRFFOOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c12-9-10-3-7-14(8-4-10)11-1-5-13-6-2-11/h1-2,5-6,10H,3-4,7-9,12H2.
What are the key properties of (1-pyridin-4-ylpiperidin-4-yl)methanamine?
(1-pyridin-4-ylpiperidin-4-yl)methanamine has a molecular weight of 191.28 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-pyridin-4-ylpiperidin-4-yl)methanamine is sourced from PubChem (CID 10607746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).