[2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine

C16H17N3 — CID 82223496

IUPAC[2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine
SMILESCc1cccc(Cc2cn3cc(CN)ccc3n2)c1
InChIInChI=1S/C16H17N3/c1-12-3-2-4-13(7-12)8-15-11-19-10-14(9-17)5-6-16(19)18-15/h2-7,10-11H,8-9,17H2,1H3
InChIKeyNMTKKMRQJAVFIF-UHFFFAOYSA-N
MW251.33 g/mol
LogP2.69
Rot. Bonds3

About [2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine

[2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine (PubChem CID 82223496) has the molecular formula C16H17N3 and a molecular weight of 251.33 g/mol. Its IUPAC name is [2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine.

Molecular Properties

Compound Name[2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine
PubChem CID82223496
Molecular FormulaC16H17N3
Molecular Weight251.33 g/mol
Exact Mass251.14
IUPAC Name[2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine
SMILESCc1cccc(Cc2cn3cc(CN)ccc3n2)c1
InChIInChI=1S/C16H17N3/c1-12-3-2-4-13(7-12)8-15-11-19-10-14(9-17)5-6-16(19)18-15/h2-7,10-11H,8-9,17H2,1H3
InChIKeyNMTKKMRQJAVFIF-UHFFFAOYSA-N
XLogP2.69
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridine-6-carboxylic acid
CID 82223479
[2-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine
CID 82223422
2-[(3-fluorophenyl)methyl]-7-methylimidazo[1,2-a]pyridine
CID 117134964
5-bromo-2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridine
CID 117132587
[2-(furan-2-ylmethyl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 117130971
[2-[(2-methoxyphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine
CID 82223649
2-[(3-methoxyphenyl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 82223597
2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 82223223
(3-methylphenyl)methanamine;hydrochloride
CID 18670917
2-[(4-bromophenyl)methyl]-6-methylimidazo[1,2-a]pyridine
CID 117130599
4-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]phenol
CID 117135218
2-benzyl-7-methylimidazo[1,2-a]pyridin-6-amine
CID 82223111

Frequently Asked Questions

What is the IUPAC name of [2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine?
The IUPAC name of [2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine (CID 82223496) is [2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine.
What is the SMILES notation for [2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine?
The canonical SMILES for [2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine is Cc1cccc(Cc2cn3cc(CN)ccc3n2)c1.
What is the InChIKey of [2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine?
The InChIKey is NMTKKMRQJAVFIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3/c1-12-3-2-4-13(7-12)8-15-11-19-10-14(9-17)5-6-16(19)18-15/h2-7,10-11H,8-9,17H2,1H3.
What are the key properties of [2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine?
[2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine has a molecular weight of 251.33 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-yl]methanamine is sourced from PubChem (CID 82223496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).