N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine

C11H17NO2 — CID 104789944

IUPACN-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine
SMILESCNC(c1ccoc1C)C1CCOC1
InChIInChI=1S/C11H17NO2/c1-8-10(4-6-14-8)11(12-2)9-3-5-13-7-9/h4,6,9,11-12H,3,5,7H2,1-2H3
InChIKeyDWSQSFAWYIEPLM-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.89
Rot. Bonds3

About N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine

N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine (PubChem CID 104789944) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine
PubChem CID104789944
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC NameN-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine
SMILESCNC(c1ccoc1C)C1CCOC1
InChIInChI=1S/C11H17NO2/c1-8-10(4-6-14-8)11(12-2)9-3-5-13-7-9/h4,6,9,11-12H,3,5,7H2,1-2H3
InChIKeyDWSQSFAWYIEPLM-UHFFFAOYSA-N
XLogP1.89
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine
CID 104789875
1-(1,9-dioxaspiro[5.5]undecan-4-yl)-N-methyl-1-(2-methylfuran-3-yl)methanamine
CID 104790003
(2-methylfuran-3-yl)-(oxolan-3-yl)methanol
CID 104789574
1-(3,5-dimethylcyclohexyl)-N-methyl-1-(2-methylfuran-3-yl)methanamine
CID 104789923
1-(5-chloro-2-methylphenyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 115856559
1-(4-bromonaphthalen-1-yl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 79597072
1-(2,5-dibromo-4-methylphenyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 81473942
1-(3,4-dimethylphenyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 61271037
1-isoquinolin-4-yl-N-methyl-1-(oxolan-3-yl)methanamine
CID 65330415
1-(4-fluorophenyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 61273212
4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine
CID 65329909
1-(2-bromo-4-methoxyphenyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 61276590

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine?
The IUPAC name of N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine (CID 104789944) is N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine is CNC(c1ccoc1C)C1CCOC1.
What is the InChIKey of N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine?
The InChIKey is DWSQSFAWYIEPLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-8-10(4-6-14-8)11(12-2)9-3-5-13-7-9/h4,6,9,11-12H,3,5,7H2,1-2H3.
What are the key properties of N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine?
N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine has a molecular weight of 195.26 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylfuran-3-yl)-1-(oxolan-3-yl)methanamine is sourced from PubChem (CID 104789944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).