[6-(2-methylpropyl)-3-pyridinyl]methanamine

C10H16N2 — CID 53274665

IUPAC[6-(2-methylpropyl)-3-pyridinyl]methanamine
SMILESCC(C)Cc1ccc(CN)cn1
InChIInChI=1S/C10H16N2/c1-8(2)5-10-4-3-9(6-11)7-12-10/h3-4,7-8H,5-6,11H2,1-2H3
InChIKeySTXHMPGOYSFQFC-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.74
Rot. Bonds3

About [6-(2-methylpropyl)-3-pyridinyl]methanamine

[6-(2-methylpropyl)-3-pyridinyl]methanamine (PubChem CID 53274665) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is [6-(2-methylpropyl)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(2-methylpropyl)-3-pyridinyl]methanamine
PubChem CID53274665
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name[6-(2-methylpropyl)-3-pyridinyl]methanamine
SMILESCC(C)Cc1ccc(CN)cn1
InChIInChI=1S/C10H16N2/c1-8(2)5-10-4-3-9(6-11)7-12-10/h3-4,7-8H,5-6,11H2,1-2H3
InChIKeySTXHMPGOYSFQFC-UHFFFAOYSA-N
XLogP1.74
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [6-(2-methylpropyl)-3-pyridinyl]methanamine?
The IUPAC name of [6-(2-methylpropyl)-3-pyridinyl]methanamine (CID 53274665) is [6-(2-methylpropyl)-3-pyridinyl]methanamine.
What is the SMILES notation for [6-(2-methylpropyl)-3-pyridinyl]methanamine?
The canonical SMILES for [6-(2-methylpropyl)-3-pyridinyl]methanamine is CC(C)Cc1ccc(CN)cn1.
What is the InChIKey of [6-(2-methylpropyl)-3-pyridinyl]methanamine?
The InChIKey is STXHMPGOYSFQFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-8(2)5-10-4-3-9(6-11)7-12-10/h3-4,7-8H,5-6,11H2,1-2H3.
What are the key properties of [6-(2-methylpropyl)-3-pyridinyl]methanamine?
[6-(2-methylpropyl)-3-pyridinyl]methanamine has a molecular weight of 164.25 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-methylpropyl)-3-pyridinyl]methanamine is sourced from PubChem (CID 53274665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).