(2,2-dimethyloxolan-3-yl)methanamine

C7H15NO — CID 68552673

IUPAC(2,2-dimethyloxolan-3-yl)methanamine
SMILESCC1(C)OCCC1CN
InChIInChI=1S/C7H15NO/c1-7(2)6(5-8)3-4-9-7/h6H,3-5,8H2,1-2H3
InChIKeyXRRWKRFQOQOCCB-UHFFFAOYSA-N
MW129.20 g/mol
LogP0.76
Rot. Bonds1

About (2,2-dimethyloxolan-3-yl)methanamine

(2,2-dimethyloxolan-3-yl)methanamine (PubChem CID 68552673) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is (2,2-dimethyloxolan-3-yl)methanamine.

Molecular Properties

Compound Name(2,2-dimethyloxolan-3-yl)methanamine
PubChem CID68552673
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name(2,2-dimethyloxolan-3-yl)methanamine
SMILESCC1(C)OCCC1CN
InChIInChI=1S/C7H15NO/c1-7(2)6(5-8)3-4-9-7/h6H,3-5,8H2,1-2H3
InChIKeyXRRWKRFQOQOCCB-UHFFFAOYSA-N
XLogP0.76
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(Oxolan-3-yl)ethan-1-amine
CID 21054629
2-(Oxolan-3-yl)propan-1-amine
CID 82593782
[(5,5-Dimethyltetrahydrofuran-3-yl)methyl]amine
CID 75464785
2-(2-Methyloxolan-2-yl)ethan-1-amine
CID 115011203
(2,2-Dimethyloxolan-3-yl)methanamine hydrochloride
CID 122164478
2-(2,2-Dimethyloxolan-3-yl)ethan-1-amine
CID 127010872
(5,5-Dimethyloxolan-3-yl)methanamine hydrochloride
CID 137944467
[4-(2-Fluoroethyl)oxolan-3-yl]methanamine
CID 115011725
1-[2-Methyl-4-(trifluoromethyl)oxolan-3-yl]methanamine
CID 165849876
(4-Ethyloxolan-3-yl)methanamine
CID 55285750
(1S)-1-(Tetrahydrofuran-3-YL)ethan-1-amine
CID 65329081
(2-Methyloxolan-3-yl)methanamine
CID 79369849

Frequently Asked Questions

What is the IUPAC name of (2,2-dimethyloxolan-3-yl)methanamine?
The IUPAC name of (2,2-dimethyloxolan-3-yl)methanamine (CID 68552673) is (2,2-dimethyloxolan-3-yl)methanamine.
What is the SMILES notation for (2,2-dimethyloxolan-3-yl)methanamine?
The canonical SMILES for (2,2-dimethyloxolan-3-yl)methanamine is CC1(C)OCCC1CN.
What is the InChIKey of (2,2-dimethyloxolan-3-yl)methanamine?
The InChIKey is XRRWKRFQOQOCCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-7(2)6(5-8)3-4-9-7/h6H,3-5,8H2,1-2H3.
What are the key properties of (2,2-dimethyloxolan-3-yl)methanamine?
(2,2-dimethyloxolan-3-yl)methanamine has a molecular weight of 129.20 g/mol, XLogP of 0.76, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethyloxolan-3-yl)methanamine is sourced from PubChem (CID 68552673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).