1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine

C7H15NO2 — CID 22308836

IUPAC1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine
SMILESCNC[C@@H]1COC(C)(C)O1
InChIInChI=1S/C7H15NO2/c1-7(2)9-5-6(10-7)4-8-3/h6,8H,4-5H2,1-3H3/t6-/m1/s1
InChIKeyWHOSTRMGZDFYCI-ZCFIWIBFSA-N
MW145.20 g/mol
LogP0.36
Rot. Bonds2

About 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine

1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine (PubChem CID 22308836) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine
PubChem CID22308836
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine
SMILESCNC[C@@H]1COC(C)(C)O1
InChIInChI=1S/C7H15NO2/c1-7(2)9-5-6(10-7)4-8-3/h6,8H,4-5H2,1-3H3/t6-/m1/s1
InChIKeyWHOSTRMGZDFYCI-ZCFIWIBFSA-N
XLogP0.36
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,3-Dioxolane-4-methanamine, 2,2-dimethyl-
CID 4122349
2-Methyl-2-(methylaminomethyl)-1,3-dioxolane
CID 853398
1,4-Dioxa-7-azaspiro(4.4)nonane
CID 15165039
(2,2-Dimethyl-1,3-dioxolan-4-yl)methanamine hydrochloride
CID 21466688
1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methanamine
CID 2733884
1-((4R)-2,2-dimethyl-1,3-dioxolan-4-yl)methanamine
CID 10154073
(4R)-N,2,2-Trimethyl-1,3-dioxolan-4-amine
CID 69292156
[(2,2-Dimethyl-1,3-dioxolan-4-yl)methyl](methyl)amine hydrochloride
CID 155943669
{[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl}(methyl)amine hydrochloride
CID 165986481
{[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl}(ethyl)amine hydrochloride
CID 165998880
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]ethane-1,2-diamine
CID 14009886
4-[(Methylamino)methyl]-1,3-dioxolan-2-one
CID 55300687

Frequently Asked Questions

What is the IUPAC name of 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine (CID 22308836) is 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine is CNC[C@@H]1COC(C)(C)O1.
What is the InChIKey of 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine?
The InChIKey is WHOSTRMGZDFYCI-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H15NO2/c1-7(2)9-5-6(10-7)4-8-3/h6,8H,4-5H2,1-3H3/t6-/m1/s1.
What are the key properties of 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine?
1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine has a molecular weight of 145.20 g/mol, XLogP of 0.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-N-methylmethanamine is sourced from PubChem (CID 22308836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).