2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline

C15H19N3 — CID 82117586

IUPAC2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline
SMILESCc1ccc(-c2cn3c(n2)CC(C)CC3)cc1N
InChIInChI=1S/C15H19N3/c1-10-5-6-18-9-14(17-15(18)7-10)12-4-3-11(2)13(16)8-12/h3-4,8-10H,5-7,16H2,1-2H3
InChIKeyVKXJCMIGYDEVON-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.02
Rot. Bonds1

About 2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline

2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline (PubChem CID 82117586) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline.

Molecular Properties

Compound Name2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline
PubChem CID82117586
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline
SMILESCc1ccc(-c2cn3c(n2)CC(C)CC3)cc1N
InChIInChI=1S/C15H19N3/c1-10-5-6-18-9-14(17-15(18)7-10)12-4-3-11(2)13(16)8-12/h3-4,8-10H,5-7,16H2,1-2H3
InChIKeyVKXJCMIGYDEVON-UHFFFAOYSA-N
XLogP3.02
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline?
The IUPAC name of 2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline (CID 82117586) is 2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline.
What is the SMILES notation for 2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline?
The canonical SMILES for 2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline is Cc1ccc(-c2cn3c(n2)CC(C)CC3)cc1N.
What is the InChIKey of 2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline?
The InChIKey is VKXJCMIGYDEVON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-10-5-6-18-9-14(17-15(18)7-10)12-4-3-11(2)13(16)8-12/h3-4,8-10H,5-7,16H2,1-2H3.
What are the key properties of 2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline?
2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline has a molecular weight of 241.34 g/mol, XLogP of 3.02, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(7-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)aniline is sourced from PubChem (CID 82117586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).