2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride

C16H26Cl2N4 — CID 120728593

IUPAC2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride
SMILESCc1ccc2nc(CN3CCCC(CCN)C3)cn2c1.Cl.Cl
InChIInChI=1S/C16H24N4.2ClH/c1-13-4-5-16-18-15(12-20(16)9-13)11-19-8-2-3-14(10-19)6-7-17;;/h4-5,9,12,14H,2-3,6-8,10-11,17H2,1H3;2*1H
InChIKeyDXWJFQXHRBVDQJ-UHFFFAOYSA-N
MW345.32 g/mol
LogP3.05
Rot. Bonds4

About 2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride

2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride (PubChem CID 120728593) has the molecular formula C16H26Cl2N4 and a molecular weight of 345.32 g/mol. Its IUPAC name is 2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride.

Molecular Properties

Compound Name2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride
PubChem CID120728593
Molecular FormulaC16H26Cl2N4
Molecular Weight345.32 g/mol
Exact Mass344.15
IUPAC Name2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride
SMILESCc1ccc2nc(CN3CCCC(CCN)C3)cn2c1.Cl.Cl
InChIInChI=1S/C16H24N4.2ClH/c1-13-4-5-16-18-15(12-20(16)9-13)11-19-8-2-3-14(10-19)6-7-17;;/h4-5,9,12,14H,2-3,6-8,10-11,17H2,1H3;2*1H
InChIKeyDXWJFQXHRBVDQJ-UHFFFAOYSA-N
XLogP3.05
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.32
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-amine;dihydrochloride
CID 119910049
(3S)-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-3-amine;dihydrochloride
CID 119933721
2-[[(3R)-3-[1-(cyclobutylmethyl)imidazol-2-yl]piperidin-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine
CID 97203298
1-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]-N-methylmethanamine
CID 61204212
2-[1-(imidazo[1,2-a]pyrimidin-2-ylmethyl)piperidin-3-yl]ethanamine;hydrochloride
CID 120967196
2-[1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-yl]ethanamine;hydrochloride
CID 120728713
methyl (3S)-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-3-carboxylate
CID 79037670
4-methyl-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-ol
CID 103897964
[4-methyl-5-[(3R)-1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]-1,2,4-triazol-3-yl]methanol
CID 124756495
2-[[(3S)-3-(methoxymethyl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 94920556
2-[1-(thiadiazol-4-ylmethyl)piperidin-3-yl]ethanamine;hydrochloride
CID 120728721
2-[1-[(4-chlorophenyl)methyl]piperidin-3-yl]ethanamine;hydrochloride
CID 120728185

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride?
The IUPAC name of 2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride (CID 120728593) is 2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride.
What is the SMILES notation for 2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride?
The canonical SMILES for 2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride is Cc1ccc2nc(CN3CCCC(CCN)C3)cn2c1.Cl.Cl.
What is the InChIKey of 2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride?
The InChIKey is DXWJFQXHRBVDQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4.2ClH/c1-13-4-5-16-18-15(12-20(16)9-13)11-19-8-2-3-14(10-19)6-7-17;;/h4-5,9,12,14H,2-3,6-8,10-11,17H2,1H3;2*1H.
What are the key properties of 2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride?
2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride has a molecular weight of 345.32 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-yl]ethanamine;dihydrochloride is sourced from PubChem (CID 120728593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).