3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline

C19H24N4 — CID 39120603

IUPAC3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline
SMILESCCN(CC)Cc1c(-c2cccc(N)c2)nc2cc(C)ccn12
InChIInChI=1S/C19H24N4/c1-4-22(5-2)13-17-19(15-7-6-8-16(20)12-15)21-18-11-14(3)9-10-23(17)18/h6-12H,4-5,13,20H2,1-3H3
InChIKeyFARBDAYHKIQBKK-UHFFFAOYSA-N
MW308.43 g/mol
LogP3.73
Rot. Bonds5

About 3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline

3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline (PubChem CID 39120603) has the molecular formula C19H24N4 and a molecular weight of 308.43 g/mol. Its IUPAC name is 3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline.

Molecular Properties

Compound Name3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline
PubChem CID39120603
Molecular FormulaC19H24N4
Molecular Weight308.43 g/mol
Exact Mass308.20
IUPAC Name3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline
SMILESCCN(CC)Cc1c(-c2cccc(N)c2)nc2cc(C)ccn12
InChIInChI=1S/C19H24N4/c1-4-22(5-2)13-17-19(15-7-6-8-16(20)12-15)21-18-11-14(3)9-10-23(17)18/h6-12H,4-5,13,20H2,1-3H3
InChIKeyFARBDAYHKIQBKK-UHFFFAOYSA-N
XLogP3.73
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[3-(azepan-1-ylmethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline
CID 39120553
3-[3-[(dimethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]aniline
CID 39120445
1-[2-(4-ethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine;dihydrochloride
CID 75537301
1-[2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine;hydrochloride
CID 126467593
1-[2-(4-methoxy-3-methylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine
CID 39145993
2-(4-bromophenyl)-3-ethyl-7-methylimidazo[1,2-a]pyridine
CID 100820877
3-(diethylaminomethyl)-2-pyridin-4-ylimidazo[1,2-a]pyridin-6-amine
CID 82058457
3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine
CID 39133020
2-(3-cyclopropylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
CID 79973037
2-[7-methyl-2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
CID 82030409
ethyl 2-amino-3-[7-methyl-2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]propanoate
CID 170885569
3-(diethylaminomethyl)-2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 94964077

Frequently Asked Questions

What is the IUPAC name of 3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline?
The IUPAC name of 3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline (CID 39120603) is 3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline.
What is the SMILES notation for 3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline?
The canonical SMILES for 3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline is CCN(CC)Cc1c(-c2cccc(N)c2)nc2cc(C)ccn12.
What is the InChIKey of 3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline?
The InChIKey is FARBDAYHKIQBKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4/c1-4-22(5-2)13-17-19(15-7-6-8-16(20)12-15)21-18-11-14(3)9-10-23(17)18/h6-12H,4-5,13,20H2,1-3H3.
What are the key properties of 3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline?
3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline has a molecular weight of 308.43 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(diethylaminomethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline is sourced from PubChem (CID 39120603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).