2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine

C23H30N4 — CID 110311811

IUPAC2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine
SMILESCC(C)(C)c1ccc(-c2nc3ccc(N)cn3c2CN2CCCCC2)cc1
InChIInChI=1S/C23H30N4/c1-23(2,3)18-9-7-17(8-10-18)22-20(16-26-13-5-4-6-14-26)27-15-19(24)11-12-21(27)25-22/h7-12,15H,4-6,13-14,16,24H2,1-3H3
InChIKeyQOYDMABIELPVCA-UHFFFAOYSA-N
MW362.52 g/mol
LogP4.87
Rot. Bonds3

About 2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine

2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine (PubChem CID 110311811) has the molecular formula C23H30N4 and a molecular weight of 362.52 g/mol. Its IUPAC name is 2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine.

Molecular Properties

Compound Name2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine
PubChem CID110311811
Molecular FormulaC23H30N4
Molecular Weight362.52 g/mol
Exact Mass362.25
IUPAC Name2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine
SMILESCC(C)(C)c1ccc(-c2nc3ccc(N)cn3c2CN2CCCCC2)cc1
InChIInChI=1S/C23H30N4/c1-23(2,3)18-9-7-17(8-10-18)22-20(16-26-13-5-4-6-14-26)27-15-19(24)11-12-21(27)25-22/h7-12,15H,4-6,13-14,16,24H2,1-3H3
InChIKeyQOYDMABIELPVCA-UHFFFAOYSA-N
XLogP4.87
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.52
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine
CID 165344231
[2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine
CID 82060626
3-[(3,5-dimethylpiperidin-1-yl)methyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[1,2-a]pyridin-6-amine
CID 110311592
3-(azocan-1-ylmethyl)-2-(4-hydroxyphenyl)-N-prop-2-ynylimidazo[1,2-a]pyridine-6-carboxamide
CID 134108516
2-(3,4-dichlorophenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 110311535
2-methyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-6-amine
CID 82058473
2-methyl-3-[(4-methylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 82058433
2-(4-methoxy-3-methylphenyl)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 110311561
3-[(2,6-dimethylpiperidin-1-yl)methyl]-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-amine
CID 110311654
2-(4-tert-butylphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine
CID 63618444
3-[3-(azepan-1-ylmethyl)-7-methylimidazo[1,2-a]pyridin-2-yl]aniline
CID 39120553
2-methyl-3-[(3-methylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 82058431

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine?
The IUPAC name of 2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine (CID 110311811) is 2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine.
What is the SMILES notation for 2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine?
The canonical SMILES for 2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine is CC(C)(C)c1ccc(-c2nc3ccc(N)cn3c2CN2CCCCC2)cc1.
What is the InChIKey of 2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine?
The InChIKey is QOYDMABIELPVCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4/c1-23(2,3)18-9-7-17(8-10-18)22-20(16-26-13-5-4-6-14-26)27-15-19(24)11-12-21(27)25-22/h7-12,15H,4-6,13-14,16,24H2,1-3H3.
What are the key properties of 2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine?
2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine has a molecular weight of 362.52 g/mol, XLogP of 4.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine is sourced from PubChem (CID 110311811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).