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

C18H32N4O — CID 134074673

IUPACN-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine
SMILESCC(C)N(C)Cc1cnc2n1CCN(CC1CCOCC1)C2C
InChIInChI=1S/C18H32N4O/c1-14(2)20(4)13-17-11-19-18-15(3)21(7-8-22(17)18)12-16-5-9-23-10-6-16/h11,14-16H,5-10,12-13H2,1-4H3
InChIKeyQLRRYGQFCHUMQZ-UHFFFAOYSA-N
MW320.48 g/mol
LogP2.53
Rot. Bonds5

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

N-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine (PubChem CID 134074673) has the molecular formula C18H32N4O and a molecular weight of 320.48 g/mol. Its IUPAC name is N-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine
PubChem CID134074673
Molecular FormulaC18H32N4O
Molecular Weight320.48 g/mol
Exact Mass320.26
IUPAC NameN-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine
SMILESCC(C)N(C)Cc1cnc2n1CCN(CC1CCOCC1)C2C
InChIInChI=1S/C18H32N4O/c1-14(2)20(4)13-17-11-19-18-15(3)21(7-8-22(17)18)12-16-5-9-23-10-6-16/h11,14-16H,5-10,12-13H2,1-4H3
InChIKeyQLRRYGQFCHUMQZ-UHFFFAOYSA-N
XLogP2.53
TPSA33.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.48
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine?
The IUPAC name of N-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine (CID 134074673) is N-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine.
What is the SMILES notation for N-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine?
The canonical SMILES for N-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine is CC(C)N(C)Cc1cnc2n1CCN(CC1CCOCC1)C2C.
What is the InChIKey of N-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine?
The InChIKey is QLRRYGQFCHUMQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N4O/c1-14(2)20(4)13-17-11-19-18-15(3)21(7-8-22(17)18)12-16-5-9-23-10-6-16/h11,14-16H,5-10,12-13H2,1-4H3.
What are the key properties of N-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine?
N-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine has a molecular weight of 320.48 g/mol, XLogP of 2.53, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[8-methyl-7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 134074673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).