(1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine

C17H19N3 — CID 81348736

IUPAC(1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine
SMILESCc1ccc([C@@H](C)NCc2cn3ccccc3n2)cc1
InChIInChI=1S/C17H19N3/c1-13-6-8-15(9-7-13)14(2)18-11-16-12-20-10-4-3-5-17(20)19-16/h3-10,12,14,18H,11H2,1-2H3/t14-/m1/s1
InChIKeyXAPVDHOCCOIHKU-CQSZACIVSA-N
MW265.36 g/mol
LogP3.49
Rot. Bonds4

About (1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine

(1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine (PubChem CID 81348736) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is (1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine.

Molecular Properties

Compound Name(1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine
PubChem CID81348736
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC Name(1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine
SMILESCc1ccc([C@@H](C)NCc2cn3ccccc3n2)cc1
InChIInChI=1S/C17H19N3/c1-13-6-8-15(9-7-13)14(2)18-11-16-12-20-10-4-3-5-17(20)19-16/h3-10,12,14,18H,11H2,1-2H3/t14-/m1/s1
InChIKeyXAPVDHOCCOIHKU-CQSZACIVSA-N
XLogP3.49
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine?
The IUPAC name of (1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine (CID 81348736) is (1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine.
What is the SMILES notation for (1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine?
The canonical SMILES for (1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine is Cc1ccc([C@@H](C)NCc2cn3ccccc3n2)cc1.
What is the InChIKey of (1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine?
The InChIKey is XAPVDHOCCOIHKU-CQSZACIVSA-N. The full InChI is InChI=1S/C17H19N3/c1-13-6-8-15(9-7-13)14(2)18-11-16-12-20-10-4-3-5-17(20)19-16/h3-10,12,14,18H,11H2,1-2H3/t14-/m1/s1.
What are the key properties of (1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine?
(1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine has a molecular weight of 265.36 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine is sourced from PubChem (CID 81348736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).