3,4-dihydro-2H-1,3-oxazin-6-amine

C4H8N2O — CID 90302998

IUPAC3,4-dihydro-2H-1,3-oxazin-6-amine
SMILESNC1=CCNCO1
InChIInChI=1S/C4H8N2O/c5-4-1-2-6-3-7-4/h1,6H,2-3,5H2
InChIKeyBKPVBJCCFYWNCS-UHFFFAOYSA-N
MW100.12 g/mol
LogP-0.64
Rot. Bonds

About 3,4-dihydro-2H-1,3-oxazin-6-amine

3,4-dihydro-2H-1,3-oxazin-6-amine (PubChem CID 90302998) has the molecular formula C4H8N2O and a molecular weight of 100.12 g/mol. Its IUPAC name is 3,4-dihydro-2H-1,3-oxazin-6-amine.

Molecular Properties

Compound Name3,4-dihydro-2H-1,3-oxazin-6-amine
PubChem CID90302998
Molecular FormulaC4H8N2O
Molecular Weight100.12 g/mol
Exact Mass100.06
IUPAC Name3,4-dihydro-2H-1,3-oxazin-6-amine
SMILESNC1=CCNCO1
InChIInChI=1S/C4H8N2O/c5-4-1-2-6-3-7-4/h1,6H,2-3,5H2
InChIKeyBKPVBJCCFYWNCS-UHFFFAOYSA-N
XLogP-0.64
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.12
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methylidene-3,4-dihydro-1,3-oxazine
CID 59114531
Ethane;2-methylidene-3,4-dihydro-1,3-oxazine
CID 91326666
(E)-1-methoxy-N-propylprop-1-en-1-amine
CID 126729823
4-Methoxy-1,2-dihydroazete
CID 174083401
N-(1-methoxyethenyl)prop-2-en-1-amine
CID 144205820
(2E)-2-(1,3-oxazinan-2-ylidene)ethanamine
CID 153396069
(Z)-N-(2-aminoethyl)-1-(aminomethoxy)prop-1-ene-1,3-diamine
CID 162731451

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-1,3-oxazin-6-amine?
The IUPAC name of 3,4-dihydro-2H-1,3-oxazin-6-amine (CID 90302998) is 3,4-dihydro-2H-1,3-oxazin-6-amine.
What is the SMILES notation for 3,4-dihydro-2H-1,3-oxazin-6-amine?
The canonical SMILES for 3,4-dihydro-2H-1,3-oxazin-6-amine is NC1=CCNCO1.
What is the InChIKey of 3,4-dihydro-2H-1,3-oxazin-6-amine?
The InChIKey is BKPVBJCCFYWNCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O/c5-4-1-2-6-3-7-4/h1,6H,2-3,5H2.
What are the key properties of 3,4-dihydro-2H-1,3-oxazin-6-amine?
3,4-dihydro-2H-1,3-oxazin-6-amine has a molecular weight of 100.12 g/mol, XLogP of -0.64, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-1,3-oxazin-6-amine is sourced from PubChem (CID 90302998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).