[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine

C16H21N3 — CID 82120368

IUPAC[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCCc1ccc(-c2nc3n(c2CN)CCCC3)cc1
InChIInChI=1S/C16H21N3/c1-2-12-6-8-13(9-7-12)16-14(11-17)19-10-4-3-5-15(19)18-16/h6-9H,2-5,10-11,17H2,1H3
InChIKeyUMQCFDBKYFLELI-UHFFFAOYSA-N
MW255.36 g/mol
LogP2.91
Rot. Bonds3

About [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine

[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine (PubChem CID 82120368) has the molecular formula C16H21N3 and a molecular weight of 255.36 g/mol. Its IUPAC name is [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine
PubChem CID82120368
Molecular FormulaC16H21N3
Molecular Weight255.36 g/mol
Exact Mass255.17
IUPAC Name[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCCc1ccc(-c2nc3n(c2CN)CCCC3)cc1
InChIInChI=1S/C16H21N3/c1-2-12-6-8-13(9-7-12)16-14(11-17)19-10-4-3-5-15(19)18-16/h6-9H,2-5,10-11,17H2,1H3
InChIKeyUMQCFDBKYFLELI-UHFFFAOYSA-N
XLogP2.91
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine?
The IUPAC name of [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine (CID 82120368) is [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine.
What is the SMILES notation for [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine?
The canonical SMILES for [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine is CCc1ccc(-c2nc3n(c2CN)CCCC3)cc1.
What is the InChIKey of [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine?
The InChIKey is UMQCFDBKYFLELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-2-12-6-8-13(9-7-12)16-14(11-17)19-10-4-3-5-15(19)18-16/h6-9H,2-5,10-11,17H2,1H3.
What are the key properties of [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine?
[2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine has a molecular weight of 255.36 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methanamine is sourced from PubChem (CID 82120368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).