1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine

C21H27N5 — CID 75470893

IUPAC1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine
SMILESCC1CN(Cc2ccccc2)CCC1N(C)Cc1cnc2cnccn12
InChIInChI=1S/C21H27N5/c1-17-14-25(15-18-6-4-3-5-7-18)10-8-20(17)24(2)16-19-12-23-21-13-22-9-11-26(19)21/h3-7,9,11-13,17,20H,8,10,14-16H2,1-2H3
InChIKeyGCOIHYJYYXLWCG-UHFFFAOYSA-N
MW349.48 g/mol
LogP3.07
Rot. Bonds5

About 1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine

1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine (PubChem CID 75470893) has the molecular formula C21H27N5 and a molecular weight of 349.48 g/mol. Its IUPAC name is 1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine
PubChem CID75470893
Molecular FormulaC21H27N5
Molecular Weight349.48 g/mol
Exact Mass349.23
IUPAC Name1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine
SMILESCC1CN(Cc2ccccc2)CCC1N(C)Cc1cnc2cnccn12
InChIInChI=1S/C21H27N5/c1-17-14-25(15-18-6-4-3-5-7-18)10-8-20(17)24(2)16-19-12-23-21-13-22-9-11-26(19)21/h3-7,9,11-13,17,20H,8,10,14-16H2,1-2H3
InChIKeyGCOIHYJYYXLWCG-UHFFFAOYSA-N
XLogP3.07
TPSA36.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.48
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-benzyl-N,N,3-trimethylpiperidin-4-amine
CID 71634856
(3R,4S)-1-benzyl-N,3-dimethyl-N-(1,3-thiazol-4-ylmethyl)piperidin-4-amine
CID 96560100
2-(4-benzylmorpholin-2-yl)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)acetamide
CID 90651071
(3S,4S)-1-benzyl-4-chloro-3-methylpiperidine
CID 97176910
(3S,4S)-1-benzyl-N-[2-(1,3-dioxolan-2-yl)ethyl]-N,3-dimethylpiperidin-4-amine
CID 99606871
N-[(3S,4S)-1-benzyl-3-methylpiperidin-4-yl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine
CID 95632240
(3R)-1-benzyl-N-methyl-N-(pyrimidin-2-ylmethyl)pyrrolidin-3-amine
CID 129335856
N-[(3R,4R)-1-benzyl-4-methylpiperidin-3-yl]-N-methylpyrido[3,4-d]pyrimidin-4-amine
CID 163348862
(3R,4R)-1-benzyl-N,4-dimethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-amine
CID 166601420
N-[(3R,4S)-1-benzyl-3-methylpiperidin-4-yl]-N-methyl-2-(methylamino)acetamide
CID 125145982
1-[(1-benzyl-3-methylpiperidin-4-yl)-methylamino]-3-propan-2-yloxypropan-2-ol
CID 111858533
(3S,4S)-1-benzyl-3-methylpiperidin-4-amine
CID 34178997

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine?
The IUPAC name of 1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine (CID 75470893) is 1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine?
The canonical SMILES for 1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine is CC1CN(Cc2ccccc2)CCC1N(C)Cc1cnc2cnccn12.
What is the InChIKey of 1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine?
The InChIKey is GCOIHYJYYXLWCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N5/c1-17-14-25(15-18-6-4-3-5-7-18)10-8-20(17)24(2)16-19-12-23-21-13-22-9-11-26(19)21/h3-7,9,11-13,17,20H,8,10,14-16H2,1-2H3.
What are the key properties of 1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine?
1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine has a molecular weight of 349.48 g/mol, XLogP of 3.07, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-N,3-dimethylpiperidin-4-amine is sourced from PubChem (CID 75470893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).