(2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane

C12H27NO — CID 142883616

IUPAC(2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane
SMILESCC.CC1C=C(CN)OC1C.CCC
InChIInChI=1S/C7H13NO.C3H8.C2H6/c1-5-3-7(4-8)9-6(5)2;1-3-2;1-2/h3,5-6H,4,8H2,1-2H3;3H2,1-2H3;1-2H3
InChIKeyHAHBKKZWCSEEIX-UHFFFAOYSA-N
MW201.35 g/mol
LogP3.33
Rot. Bonds1

About (2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane

(2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane (PubChem CID 142883616) has the molecular formula C12H27NO and a molecular weight of 201.35 g/mol. Its IUPAC name is (2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane.

Molecular Properties

Compound Name(2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane
PubChem CID142883616
Molecular FormulaC12H27NO
Molecular Weight201.35 g/mol
Exact Mass201.21
IUPAC Name(2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane
SMILESCC.CC1C=C(CN)OC1C.CCC
InChIInChI=1S/C7H13NO.C3H8.C2H6/c1-5-3-7(4-8)9-6(5)2;1-3-2;1-2/h3,5-6H,4,8H2,1-2H3;3H2,1-2H3;1-2H3
InChIKeyHAHBKKZWCSEEIX-UHFFFAOYSA-N
XLogP3.33
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.35
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane?
The IUPAC name of (2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane (CID 142883616) is (2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane.
What is the SMILES notation for (2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane?
The canonical SMILES for (2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane is CC.CC1C=C(CN)OC1C.CCC.
What is the InChIKey of (2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane?
The InChIKey is HAHBKKZWCSEEIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO.C3H8.C2H6/c1-5-3-7(4-8)9-6(5)2;1-3-2;1-2/h3,5-6H,4,8H2,1-2H3;3H2,1-2H3;1-2H3.
What are the key properties of (2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane?
(2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane has a molecular weight of 201.35 g/mol, XLogP of 3.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dimethyl-2,3-dihydrofuran-5-yl)methanamine;ethane;propane is sourced from PubChem (CID 142883616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).