1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine

C15H26N4 — CID 80634559

IUPAC1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine
SMILESCC(N)Cc1ccc(N2CCC(N(C)C)CC2)nc1
InChIInChI=1S/C15H26N4/c1-12(16)10-13-4-5-15(17-11-13)19-8-6-14(7-9-19)18(2)3/h4-5,11-12,14H,6-10,16H2,1-3H3
InChIKeyOOMIJIJMWWKPKO-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.50
Rot. Bonds4

About 1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine

1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine (PubChem CID 80634559) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine
PubChem CID80634559
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine
SMILESCC(N)Cc1ccc(N2CCC(N(C)C)CC2)nc1
InChIInChI=1S/C15H26N4/c1-12(16)10-13-4-5-15(17-11-13)19-8-6-14(7-9-19)18(2)3/h4-5,11-12,14H,6-10,16H2,1-3H3
InChIKeyOOMIJIJMWWKPKO-UHFFFAOYSA-N
XLogP1.50
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine?
The IUPAC name of 1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine (CID 80634559) is 1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine?
The canonical SMILES for 1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine is CC(N)Cc1ccc(N2CCC(N(C)C)CC2)nc1.
What is the InChIKey of 1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine?
The InChIKey is OOMIJIJMWWKPKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-12(16)10-13-4-5-15(17-11-13)19-8-6-14(7-9-19)18(2)3/h4-5,11-12,14H,6-10,16H2,1-3H3.
What are the key properties of 1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine?
1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2-aminopropyl)-2-pyridinyl]-N,N-dimethylpiperidin-4-amine is sourced from PubChem (CID 80634559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).