8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

C17H29N3O2 — CID 118742735

IUPAC8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESCC(C)N1CCn2c(COCC3CCOCC3)cnc2C1C
InChIInChI=1S/C17H29N3O2/c1-13(2)19-6-7-20-16(10-18-17(20)14(19)3)12-22-11-15-4-8-21-9-5-15/h10,13-15H,4-9,11-12H2,1-3H3
InChIKeyBAHANTTWALNWMT-UHFFFAOYSA-N
MW307.44 g/mol
LogP2.61
Rot. Bonds5

About 8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (PubChem CID 118742735) has the molecular formula C17H29N3O2 and a molecular weight of 307.44 g/mol. Its IUPAC name is 8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
PubChem CID118742735
Molecular FormulaC17H29N3O2
Molecular Weight307.44 g/mol
Exact Mass307.23
IUPAC Name8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESCC(C)N1CCn2c(COCC3CCOCC3)cnc2C1C
InChIInChI=1S/C17H29N3O2/c1-13(2)19-6-7-20-16(10-18-17(20)14(19)3)12-22-11-15-4-8-21-9-5-15/h10,13-15H,4-9,11-12H2,1-3H3
InChIKeyBAHANTTWALNWMT-UHFFFAOYSA-N
XLogP2.61
TPSA39.52 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.44
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The IUPAC name of 8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (CID 118742735) is 8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.
What is the SMILES notation for 8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The canonical SMILES for 8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is CC(C)N1CCn2c(COCC3CCOCC3)cnc2C1C.
What is the InChIKey of 8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The InChIKey is BAHANTTWALNWMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O2/c1-13(2)19-6-7-20-16(10-18-17(20)14(19)3)12-22-11-15-4-8-21-9-5-15/h10,13-15H,4-9,11-12H2,1-3H3.
What are the key properties of 8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine has a molecular weight of 307.44 g/mol, XLogP of 2.61, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-(oxan-4-ylmethoxymethyl)-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is sourced from PubChem (CID 118742735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).