1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine

C18H20ClN3 — CID 94964221

IUPAC1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine
SMILESCc1cccn2c(CN(C)C)c(Cc3ccc(Cl)cc3)nc12
InChIInChI=1S/C18H20ClN3/c1-13-5-4-10-22-17(12-21(2)3)16(20-18(13)22)11-14-6-8-15(19)9-7-14/h4-10H,11-12H2,1-3H3
InChIKeyJINBTFMSLSCLEE-UHFFFAOYSA-N
MW313.83 g/mol
LogP3.95
Rot. Bonds4

About 1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine

1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine (PubChem CID 94964221) has the molecular formula C18H20ClN3 and a molecular weight of 313.83 g/mol. Its IUPAC name is 1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine
PubChem CID94964221
Molecular FormulaC18H20ClN3
Molecular Weight313.83 g/mol
Exact Mass313.13
IUPAC Name1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine
SMILESCc1cccn2c(CN(C)C)c(Cc3ccc(Cl)cc3)nc12
InChIInChI=1S/C18H20ClN3/c1-13-5-4-10-22-17(12-21(2)3)16(20-18(13)22)11-14-6-8-15(19)9-7-14/h4-10H,11-12H2,1-3H3
InChIKeyJINBTFMSLSCLEE-UHFFFAOYSA-N
XLogP3.95
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.83
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-benzyl-8-methylimidazo[1,2-a]pyridin-3-yl)-N,N-dimethylmethanamine
CID 82223087
N,N-dimethyl-1-[8-methyl-2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-3-yl]methanamine
CID 82223475
2-[8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridin-3-yl]ethanamine
CID 82223219
1-[2-(2,4-dichlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine
CID 39146113
2-[[(4-chlorophenyl)methyl-ethylamino]methyl]-9-methylpyrido[1,2-a]pyrimidin-4-one
CID 50787833
8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
CID 82529082
(3-chloro-8-methylimidazo[1,2-a]pyridin-2-yl)methanamine
CID 83685848
1-[2-(2,5-dimethoxyphenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine
CID 39146199
2-[(4-chlorophenoxy)methyl]-8-methylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 94968829
2-benzyl-3-[(dimethylamino)methyl]imidazo[1,2-a]pyridin-6-amine
CID 82223100
[2-[(4-chlorophenyl)methyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methanol
CID 82223695
2-chloro-8-methylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 82529691

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine (CID 94964221) is 1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine is Cc1cccn2c(CN(C)C)c(Cc3ccc(Cl)cc3)nc12.
What is the InChIKey of 1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine?
The InChIKey is JINBTFMSLSCLEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClN3/c1-13-5-4-10-22-17(12-21(2)3)16(20-18(13)22)11-14-6-8-15(19)9-7-14/h4-10H,11-12H2,1-3H3.
What are the key properties of 1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine?
1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine has a molecular weight of 313.83 g/mol, XLogP of 3.95, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 94964221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).