[3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine

C11H17NO2 — CID 114534069

IUPAC[3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine
SMILESCC1OCCC1(CN)Cc1ccoc1
InChIInChI=1S/C11H17NO2/c1-9-11(8-12,3-5-14-9)6-10-2-4-13-7-10/h2,4,7,9H,3,5-6,8,12H2,1H3
InChIKeyMHKSXQPLFCEMBJ-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.58
Rot. Bonds3

About [3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine

[3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine (PubChem CID 114534069) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is [3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine.

Molecular Properties

Compound Name[3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine
PubChem CID114534069
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name[3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine
SMILESCC1OCCC1(CN)Cc1ccoc1
InChIInChI=1S/C11H17NO2/c1-9-11(8-12,3-5-14-9)6-10-2-4-13-7-10/h2,4,7,9H,3,5-6,8,12H2,1H3
InChIKeyMHKSXQPLFCEMBJ-UHFFFAOYSA-N
XLogP1.58
TPSA48.39 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 ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanol
CID 114535679
[2-methyl-3-(thiophen-3-ylmethyl)oxolan-3-yl]methanamine
CID 114534046
(3-ethyl-2-methyloxolan-3-yl)methanamine
CID 114533945
[3-[(2-methoxyphenyl)methyl]-2-methyloxolan-3-yl]methanamine
CID 114533952
[3-ethyl-1-(furan-3-ylmethyl)cyclopentyl]methanamine
CID 83182822
[3-[(4-bromo-2-chlorophenyl)methyl]-2-methyloxolan-3-yl]methanamine
CID 114534026
[2-methyl-3-[(2-methyltetrazol-5-yl)methyl]oxolan-3-yl]methanamine
CID 107053595
[3-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methyloxolan-3-yl]methanamine
CID 114533961
[2-(furan-3-ylmethyl)-1,3-dihydroinden-2-yl]methanamine
CID 83183020
1-(furan-3-ylmethyl)-3-methylcyclobutan-1-ol
CID 103564546
1-(furan-3-ylmethyl)-4-propan-2-ylcyclohexan-1-amine
CID 83183625
[3-[2-(4-bromophenoxy)ethyl]-2-methyloxolan-3-yl]methanamine
CID 114533972

Frequently Asked Questions

What is the IUPAC name of [3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine?
The IUPAC name of [3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine (CID 114534069) is [3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine.
What is the SMILES notation for [3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine?
The canonical SMILES for [3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine is CC1OCCC1(CN)Cc1ccoc1.
What is the InChIKey of [3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine?
The InChIKey is MHKSXQPLFCEMBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-9-11(8-12,3-5-14-9)6-10-2-4-13-7-10/h2,4,7,9H,3,5-6,8,12H2,1H3.
What are the key properties of [3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine?
[3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine has a molecular weight of 195.26 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine is sourced from PubChem (CID 114534069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).