N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine

C12H21N3O — CID 75367326

IUPACN-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine
SMILESCC(C)(C)CNC[C@H]1Cn2ccnc2CO1
InChIInChI=1S/C12H21N3O/c1-12(2,3)9-13-6-10-7-15-5-4-14-11(15)8-16-10/h4-5,10,13H,6-9H2,1-3H3/t10-/m0/s1
InChIKeyZPSCXIGOTQSIKF-JTQLQIEISA-N
MW223.32 g/mol
LogP1.42
Rot. Bonds3

About N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine

N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine (PubChem CID 75367326) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine
PubChem CID75367326
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC NameN-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine
SMILESCC(C)(C)CNC[C@H]1Cn2ccnc2CO1
InChIInChI=1S/C12H21N3O/c1-12(2,3)9-13-6-10-7-15-5-4-14-11(15)8-16-10/h4-5,10,13H,6-9H2,1-3H3/t10-/m0/s1
InChIKeyZPSCXIGOTQSIKF-JTQLQIEISA-N
XLogP1.42
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine?
The IUPAC name of N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine (CID 75367326) is N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine.
What is the SMILES notation for N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine?
The canonical SMILES for N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine is CC(C)(C)CNC[C@H]1Cn2ccnc2CO1.
What is the InChIKey of N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine?
The InChIKey is ZPSCXIGOTQSIKF-JTQLQIEISA-N. The full InChI is InChI=1S/C12H21N3O/c1-12(2,3)9-13-6-10-7-15-5-4-14-11(15)8-16-10/h4-5,10,13H,6-9H2,1-3H3/t10-/m0/s1.
What are the key properties of N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine?
N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine has a molecular weight of 223.32 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2,2-dimethylpropan-1-amine is sourced from PubChem (CID 75367326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).