2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine

C24H28Cl2N4 — CID 110311776

IUPAC2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine
SMILESCC1(C)CC2CC(C)(CN2Cc2c(-c3ccc(Cl)cc3Cl)nc3ccc(N)cn23)C1
InChIInChI=1S/C24H28Cl2N4/c1-23(2)9-17-10-24(3,13-23)14-29(17)12-20-22(18-6-4-15(25)8-19(18)26)28-21-7-5-16(27)11-30(20)21/h4-8,11,17H,9-10,12-14,27H2,1-3H3
InChIKeyIIIDRFFUSBQIBD-UHFFFAOYSA-N
MW443.42 g/mol
LogP6.29
Rot. Bonds3

About 2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine

2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine (PubChem CID 110311776) has the molecular formula C24H28Cl2N4 and a molecular weight of 443.42 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine
PubChem CID110311776
Molecular FormulaC24H28Cl2N4
Molecular Weight443.42 g/mol
Exact Mass442.17
IUPAC Name2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine
SMILESCC1(C)CC2CC(C)(CN2Cc2c(-c3ccc(Cl)cc3Cl)nc3ccc(N)cn23)C1
InChIInChI=1S/C24H28Cl2N4/c1-23(2)9-17-10-24(3,13-23)14-29(17)12-20-22(18-6-4-15(25)8-19(18)26)28-21-7-5-16(27)11-30(20)21/h4-8,11,17H,9-10,12-14,27H2,1-3H3
InChIKeyIIIDRFFUSBQIBD-UHFFFAOYSA-N
XLogP6.29
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.42
LogP ≤ 56.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine with MolForge

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Related Compounds

2-(4-methoxy-3-methylphenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 110311784
6-[6-amino-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-2-yl]-4H-1,4-benzoxazin-3-one
CID 110311797
2-(4-ethoxy-3-nitrophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 110311805
6-chloro-3-(chloromethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine
CID 82029741
(1S,5S)-1,3,3-trimethyl-6-[(4-nitrophenyl)methyl]-6-azabicyclo[3.2.1]octane
CID 98108756
(1S,5R)-6-[(1,4-dimethylpyrazol-5-yl)methyl]-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane
CID 77086156
4-[[2-(2,4-dichlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine
CID 121309712
6-chloro-2-methyl-3-[[(1S,5S)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]-1H-quinolin-4-one
CID 98089157
(2R)-1-(3,6-dichlorocarbazol-9-yl)-3-[(1S,5S)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]propan-2-ol
CID 98671631
N-(4-amino-2-chlorophenyl)-2-oxo-2-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)acetamide
CID 108516140
7-chloro-4-methyl-2-[(1S,5S)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]quinoline
CID 98113090
N-(4-aminophenyl)-2-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)acetamide
CID 82224567

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine?
The IUPAC name of 2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine (CID 110311776) is 2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine?
The canonical SMILES for 2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine is CC1(C)CC2CC(C)(CN2Cc2c(-c3ccc(Cl)cc3Cl)nc3ccc(N)cn23)C1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine?
The InChIKey is IIIDRFFUSBQIBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28Cl2N4/c1-23(2)9-17-10-24(3,13-23)14-29(17)12-20-22(18-6-4-15(25)8-19(18)26)28-21-7-5-16(27)11-30(20)21/h4-8,11,17H,9-10,12-14,27H2,1-3H3.
What are the key properties of 2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine?
2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine has a molecular weight of 443.42 g/mol, XLogP of 6.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-3-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]imidazo[1,2-a]pyridin-6-amine is sourced from PubChem (CID 110311776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).