methanamine;2-methyloxan-4-amine

C7H18N2O — CID 156712849

IUPACmethanamine;2-methyloxan-4-amine
SMILESCC1CC(N)CCO1.CN
InChIInChI=1S/C6H13NO.CH5N/c1-5-4-6(7)2-3-8-5;1-2/h5-6H,2-4,7H2,1H3;2H2,1H3
InChIKeyKURXASQPPAVKDU-UHFFFAOYSA-N
MW146.23 g/mol
LogP0.09
Rot. Bonds

About methanamine;2-methyloxan-4-amine

methanamine;2-methyloxan-4-amine (PubChem CID 156712849) has the molecular formula C7H18N2O and a molecular weight of 146.23 g/mol. Its IUPAC name is methanamine;2-methyloxan-4-amine.

Molecular Properties

Compound Namemethanamine;2-methyloxan-4-amine
PubChem CID156712849
Molecular FormulaC7H18N2O
Molecular Weight146.23 g/mol
Exact Mass146.14
IUPAC Namemethanamine;2-methyloxan-4-amine
SMILESCC1CC(N)CCO1.CN
InChIInChI=1S/C6H13NO.CH5N/c1-5-4-6(7)2-3-8-5;1-2/h5-6H,2-4,7H2,1H3;2H2,1H3
InChIKeyKURXASQPPAVKDU-UHFFFAOYSA-N
XLogP0.09
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-Dimethyloxan-4-amine
CID 420586
2-Methyloxan-4-amine
CID 23123995
2-Ethyloxan-4-amine
CID 23124001
rac-(2R,6S)-2,6-dimethyloxan-4-amine
CID 66733532
rac-(2R,4R)-2-methyloxan-4-amine hydrochloride
CID 118868154
rac-(2R,4R)-2-ethyloxan-4-amine hydrochloride
CID 145910135
rac-(2R,4S)-2-methyloxan-4-amine hydrochloride
CID 154796566
N,2-dimethyloxan-4-amine hydrochloride
CID 154857191
Methyl-(2-methyl-tetrahydro-pyran-4-yl)-amine
CID 21919227
(2,6-Dimethyloxan-4-yl)hydrazine
CID 81852392
1-(Oxan-2-yl)propan-2-amine
CID 21843633
4-(4-Aminopentan-2-yloxy)pentan-2-amine
CID 22012872

Frequently Asked Questions

What is the IUPAC name of methanamine;2-methyloxan-4-amine?
The IUPAC name of methanamine;2-methyloxan-4-amine (CID 156712849) is methanamine;2-methyloxan-4-amine.
What is the SMILES notation for methanamine;2-methyloxan-4-amine?
The canonical SMILES for methanamine;2-methyloxan-4-amine is CC1CC(N)CCO1.CN.
What is the InChIKey of methanamine;2-methyloxan-4-amine?
The InChIKey is KURXASQPPAVKDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.CH5N/c1-5-4-6(7)2-3-8-5;1-2/h5-6H,2-4,7H2,1H3;2H2,1H3.
What are the key properties of methanamine;2-methyloxan-4-amine?
methanamine;2-methyloxan-4-amine has a molecular weight of 146.23 g/mol, XLogP of 0.09, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;2-methyloxan-4-amine is sourced from PubChem (CID 156712849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).