1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine

C13H18N4O — CID 121229592

IUPAC1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine
SMILESCN(Cc1cn2c(n1)CNCC2)Cc1ccco1
InChIInChI=1S/C13H18N4O/c1-16(10-12-3-2-6-18-12)8-11-9-17-5-4-14-7-13(17)15-11/h2-3,6,9,14H,4-5,7-8,10H2,1H3
InChIKeyLBMQRXDRRCNCJA-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.21
Rot. Bonds4

About 1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine

1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine (PubChem CID 121229592) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine
PubChem CID121229592
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine
SMILESCN(Cc1cn2c(n1)CNCC2)Cc1ccco1
InChIInChI=1S/C13H18N4O/c1-16(10-12-3-2-6-18-12)8-11-9-17-5-4-14-7-13(17)15-11/h2-3,6,9,14H,4-5,7-8,10H2,1H3
InChIKeyLBMQRXDRRCNCJA-UHFFFAOYSA-N
XLogP1.21
TPSA46.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine?
The IUPAC name of 1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine (CID 121229592) is 1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine.
What is the SMILES notation for 1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine?
The canonical SMILES for 1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine is CN(Cc1cn2c(n1)CNCC2)Cc1ccco1.
What is the InChIKey of 1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine?
The InChIKey is LBMQRXDRRCNCJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-16(10-12-3-2-6-18-12)8-11-9-17-5-4-14-7-13(17)15-11/h2-3,6,9,14H,4-5,7-8,10H2,1H3.
What are the key properties of 1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine?
1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine has a molecular weight of 246.31 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-ylmethyl)methanamine is sourced from PubChem (CID 121229592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).