1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine

C12H18N4 — CID 79295628

IUPAC1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine
SMILESCCCC(CC)n1c(N)nc2cnccc21
InChIInChI=1S/C12H18N4/c1-3-5-9(4-2)16-11-6-7-14-8-10(11)15-12(16)13/h6-9H,3-5H2,1-2H3,(H2,13,15)
InChIKeyONATVPJTSKBJKK-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.76
Rot. Bonds4

About 1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine

1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine (PubChem CID 79295628) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine.

Molecular Properties

Compound Name1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine
PubChem CID79295628
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine
SMILESCCCC(CC)n1c(N)nc2cnccc21
InChIInChI=1S/C12H18N4/c1-3-5-9(4-2)16-11-6-7-14-8-10(11)15-12(16)13/h6-9H,3-5H2,1-2H3,(H2,13,15)
InChIKeyONATVPJTSKBJKK-UHFFFAOYSA-N
XLogP2.76
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine?
The IUPAC name of 1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine (CID 79295628) is 1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine.
What is the SMILES notation for 1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine?
The canonical SMILES for 1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine is CCCC(CC)n1c(N)nc2cnccc21.
What is the InChIKey of 1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine?
The InChIKey is ONATVPJTSKBJKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-3-5-9(4-2)16-11-6-7-14-8-10(11)15-12(16)13/h6-9H,3-5H2,1-2H3,(H2,13,15).
What are the key properties of 1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine?
1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine has a molecular weight of 218.30 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hexan-3-ylimidazo[4,5-c]pyridin-2-amine is sourced from PubChem (CID 79295628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).