1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine

C14H17ClN4 — CID 63024711

IUPAC1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine
SMILESCNCc1c(Cl)cccc1N1CCn2ccnc2C1
InChIInChI=1S/C14H17ClN4/c1-16-9-11-12(15)3-2-4-13(11)19-8-7-18-6-5-17-14(18)10-19/h2-6,16H,7-10H2,1H3
InChIKeyAHEOTCGJTIIJKB-UHFFFAOYSA-N
MW276.77 g/mol
LogP2.28
Rot. Bonds3

About 1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine

1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine (PubChem CID 63024711) has the molecular formula C14H17ClN4 and a molecular weight of 276.77 g/mol. Its IUPAC name is 1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine
PubChem CID63024711
Molecular FormulaC14H17ClN4
Molecular Weight276.77 g/mol
Exact Mass276.11
IUPAC Name1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine
SMILESCNCc1c(Cl)cccc1N1CCn2ccnc2C1
InChIInChI=1S/C14H17ClN4/c1-16-9-11-12(15)3-2-4-13(11)19-8-7-18-6-5-17-14(18)10-19/h2-6,16H,7-10H2,1H3
InChIKeyAHEOTCGJTIIJKB-UHFFFAOYSA-N
XLogP2.28
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine?
The IUPAC name of 1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine (CID 63024711) is 1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine is CNCc1c(Cl)cccc1N1CCn2ccnc2C1.
What is the InChIKey of 1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine?
The InChIKey is AHEOTCGJTIIJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN4/c1-16-9-11-12(15)3-2-4-13(11)19-8-7-18-6-5-17-14(18)10-19/h2-6,16H,7-10H2,1H3.
What are the key properties of 1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine?
1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine has a molecular weight of 276.77 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]-N-methylmethanamine is sourced from PubChem (CID 63024711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).