[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline

C22H30N6 — CID 143196391

IUPAC[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline
SMILESCN1CCN(c2cccc3nc(CN)cn23)CC1.c1cnc2c(c1)CCCC2
InChIInChI=1S/C13H19N5.C9H11N/c1-16-5-7-17(8-6-16)13-4-2-3-12-15-11(9-14)10-18(12)13;1-2-6-9-8(4-1)5-3-7-10-9/h2-4,10H,5-9,14H2,1H3;3,5,7H,1-2,4,6H2
InChIKeyUAIUGGAGEFQRAX-UHFFFAOYSA-N
MW378.52 g/mol
LogP2.51
Rot. Bonds2

About [5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline

[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline (PubChem CID 143196391) has the molecular formula C22H30N6 and a molecular weight of 378.52 g/mol. Its IUPAC name is [5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline.

Molecular Properties

Compound Name[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline
PubChem CID143196391
Molecular FormulaC22H30N6
Molecular Weight378.52 g/mol
Exact Mass378.25
IUPAC Name[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline
SMILESCN1CCN(c2cccc3nc(CN)cn23)CC1.c1cnc2c(c1)CCCC2
InChIInChI=1S/C13H19N5.C9H11N/c1-16-5-7-17(8-6-16)13-4-2-3-12-15-11(9-14)10-18(12)13;1-2-6-9-8(4-1)5-3-7-10-9/h2-4,10H,5-9,14H2,1H3;3,5,7H,1-2,4,6H2
InChIKeyUAIUGGAGEFQRAX-UHFFFAOYSA-N
XLogP2.51
TPSA62.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.52
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-pyridin-2-ylmethanamine;5,6,7,8-tetrahydroquinoline
CID 143208914
N-methyl-1-[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]ethanamine;5,6,7,8-tetrahydroquinoline
CID 143198321
[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanol
CID 58985317
(8S)-N-[(2-methoxyphenyl)methyl]-N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 11591360
(8S)-N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-N-[[4-(trifluoromethyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 11627977
N-[[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-1-(4-phenylphenyl)methanamine
CID 143198338
5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine
CID 141140259
N-[[5-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]methyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 11545595
N-[[5-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]imidazo[1,2-a]pyridin-2-yl]methyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 11509653
(8S)-N-[[5-[3-(dimethylamino)pyrrolidin-1-yl]imidazo[1,2-a]pyridin-2-yl]methyl]-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 159098315
2-[6-(3-cyclopropyl-2-pyridinyl)-1-methylpiperidin-2-yl]-5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridine
CID 145424641
12-azabicyclo[9.4.0]pentadeca-1(11),12,14-triene
CID 175984451

Frequently Asked Questions

What is the IUPAC name of [5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline?
The IUPAC name of [5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline (CID 143196391) is [5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline.
What is the SMILES notation for [5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline?
The canonical SMILES for [5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline is CN1CCN(c2cccc3nc(CN)cn23)CC1.c1cnc2c(c1)CCCC2.
What is the InChIKey of [5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline?
The InChIKey is UAIUGGAGEFQRAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5.C9H11N/c1-16-5-7-17(8-6-16)13-4-2-3-12-15-11(9-14)10-18(12)13;1-2-6-9-8(4-1)5-3-7-10-9/h2-4,10H,5-9,14H2,1H3;3,5,7H,1-2,4,6H2.
What are the key properties of [5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline?
[5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline has a molecular weight of 378.52 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]methanamine;5,6,7,8-tetrahydroquinoline is sourced from PubChem (CID 143196391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).