5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine

C14H24N4 — CID 55046277

IUPAC5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine
SMILESCCN1CCC(N(C)Cc2ccc(N)nc2)CC1
InChIInChI=1S/C14H24N4/c1-3-18-8-6-13(7-9-18)17(2)11-12-4-5-14(15)16-10-12/h4-5,10,13H,3,6-9,11H2,1-2H3,(H2,15,16)
InChIKeyKVQKFABNOYTATO-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.58
Rot. Bonds4

About 5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine

5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine (PubChem CID 55046277) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine
PubChem CID55046277
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine
SMILESCCN1CCC(N(C)Cc2ccc(N)nc2)CC1
InChIInChI=1S/C14H24N4/c1-3-18-8-6-13(7-9-18)17(2)11-12-4-5-14(15)16-10-12/h4-5,10,13H,3,6-9,11H2,1-2H3,(H2,15,16)
InChIKeyKVQKFABNOYTATO-UHFFFAOYSA-N
XLogP1.58
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine?
The IUPAC name of 5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine (CID 55046277) is 5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine.
What is the SMILES notation for 5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine?
The canonical SMILES for 5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine is CCN1CCC(N(C)Cc2ccc(N)nc2)CC1.
What is the InChIKey of 5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine?
The InChIKey is KVQKFABNOYTATO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-3-18-8-6-13(7-9-18)17(2)11-12-4-5-14(15)16-10-12/h4-5,10,13H,3,6-9,11H2,1-2H3,(H2,15,16).
What are the key properties of 5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine?
5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine has a molecular weight of 248.37 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]pyridin-2-amine is sourced from PubChem (CID 55046277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).