N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine

C18H20ClN3 — CID 809280

IUPACN-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cccn2c(NC(C)(C)C)c(-c3cccc(Cl)c3)nc12
InChIInChI=1S/C18H20ClN3/c1-12-7-6-10-22-16(12)20-15(17(22)21-18(2,3)4)13-8-5-9-14(19)11-13/h5-11,21H,1-4H3
InChIKeyXDTYUKVJBPZCGG-UHFFFAOYSA-N
MW313.83 g/mol
LogP5.17
Rot. Bonds2

About N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine

N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine (PubChem CID 809280) has the molecular formula C18H20ClN3 and a molecular weight of 313.83 g/mol. Its IUPAC name is N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine
PubChem CID809280
Molecular FormulaC18H20ClN3
Molecular Weight313.83 g/mol
Exact Mass313.13
IUPAC NameN-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cccn2c(NC(C)(C)C)c(-c3cccc(Cl)c3)nc12
InChIInChI=1S/C18H20ClN3/c1-12-7-6-10-22-16(12)20-15(17(22)21-18(2,3)4)13-8-5-9-14(19)11-13/h5-11,21H,1-4H3
InChIKeyXDTYUKVJBPZCGG-UHFFFAOYSA-N
XLogP5.17
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500313.83
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-(3-chlorophenyl)imidazo[1,2-a]pyridin-3-amine
CID 809106
N-tert-butyl-2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]-8-methylimidazo[1,2-a]pyridin-3-amine
CID 121406020
8-bromo-2-(3-chlorophenyl)-3-methylimidazo[1,2-a]pyridine
CID 113303470
2-(3,4-dichlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine
CID 56687055
8-methyl-2-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-amine
CID 63616784
8-methyl-3-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-phenylimidazo[1,2-a]pyridine
CID 122382361
5-methyl-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-1,2-oxazole-3-carboxamide
CID 60520237
[3-[3-(tert-butylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-chlorobenzenesulfonate
CID 3536356
[3-[3-(benzylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]phenyl] 2-chloropropanoate
CID 3899423
2-(3-chlorophenyl)-N-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrimidin-3-amine
CID 20952820
2-[[3-(tert-butylamino)-2-phenylimidazo[1,2-a]pyridine-8-carbonyl]amino]propanoic acid
CID 23966551
8-methyl-2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 122222293

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine (CID 809280) is N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine is Cc1cccn2c(NC(C)(C)C)c(-c3cccc(Cl)c3)nc12.
What is the InChIKey of N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is XDTYUKVJBPZCGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClN3/c1-12-7-6-10-22-16(12)20-15(17(22)21-18(2,3)4)13-8-5-9-14(19)11-13/h5-11,21H,1-4H3.
What are the key properties of N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine?
N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 313.83 g/mol, XLogP of 5.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(3-chlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 809280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).