N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine

C18H25FN4 — CID 97471121

IUPACN-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine
SMILESCC(C)N(C)Cc1cnc2n1CCN(Cc1ccc(F)cc1)C2
InChIInChI=1S/C18H25FN4/c1-14(2)21(3)12-17-10-20-18-13-22(8-9-23(17)18)11-15-4-6-16(19)7-5-15/h4-7,10,14H,8-9,11-13H2,1-3H3
InChIKeySQOACFRQAZKTTE-UHFFFAOYSA-N
MW316.42 g/mol
LogP2.88
Rot. Bonds5

About N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine

N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine (PubChem CID 97471121) has the molecular formula C18H25FN4 and a molecular weight of 316.42 g/mol. Its IUPAC name is N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine
PubChem CID97471121
Molecular FormulaC18H25FN4
Molecular Weight316.42 g/mol
Exact Mass316.21
IUPAC NameN-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine
SMILESCC(C)N(C)Cc1cnc2n1CCN(Cc1ccc(F)cc1)C2
InChIInChI=1S/C18H25FN4/c1-14(2)21(3)12-17-10-20-18-13-22(8-9-23(17)18)11-15-4-6-16(19)7-5-15/h4-7,10,14H,8-9,11-13H2,1-3H3
InChIKeySQOACFRQAZKTTE-UHFFFAOYSA-N
XLogP2.88
TPSA24.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.42
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine?
The IUPAC name of N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine (CID 97471121) is N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine.
What is the SMILES notation for N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine?
The canonical SMILES for N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine is CC(C)N(C)Cc1cnc2n1CCN(Cc1ccc(F)cc1)C2.
What is the InChIKey of N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine?
The InChIKey is SQOACFRQAZKTTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25FN4/c1-14(2)21(3)12-17-10-20-18-13-22(8-9-23(17)18)11-15-4-6-16(19)7-5-15/h4-7,10,14H,8-9,11-13H2,1-3H3.
What are the key properties of N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine?
N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine has a molecular weight of 316.42 g/mol, XLogP of 2.88, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[7-[(4-fluorophenyl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-N-methylpropan-2-amine is sourced from PubChem (CID 97471121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).