1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine

C15H26N4 — CID 63171615

IUPAC1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine
SMILESCCN(CC)C1CCN(c2nc(C)ccc2CN)C1
InChIInChI=1S/C15H26N4/c1-4-18(5-2)14-8-9-19(11-14)15-13(10-16)7-6-12(3)17-15/h6-7,14H,4-5,8-11,16H2,1-3H3
InChIKeyYFDCTECYVWJJDV-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.77
Rot. Bonds5

About 1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine

1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine (PubChem CID 63171615) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine
PubChem CID63171615
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine
SMILESCCN(CC)C1CCN(c2nc(C)ccc2CN)C1
InChIInChI=1S/C15H26N4/c1-4-18(5-2)14-8-9-19(11-14)15-13(10-16)7-6-12(3)17-15/h6-7,14H,4-5,8-11,16H2,1-3H3
InChIKeyYFDCTECYVWJJDV-UHFFFAOYSA-N
XLogP1.77
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine?
The IUPAC name of 1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine (CID 63171615) is 1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine.
What is the SMILES notation for 1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine?
The canonical SMILES for 1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine is CCN(CC)C1CCN(c2nc(C)ccc2CN)C1.
What is the InChIKey of 1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine?
The InChIKey is YFDCTECYVWJJDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-4-18(5-2)14-8-9-19(11-14)15-13(10-16)7-6-12(3)17-15/h6-7,14H,4-5,8-11,16H2,1-3H3.
What are the key properties of 1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine?
1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine has a molecular weight of 262.40 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(aminomethyl)-6-methyl-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine is sourced from PubChem (CID 63171615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).