N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine

C10H18N2O — CID 175885568

IUPACN-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine
SMILESCN1CCCC(NC2=COCC2)C1
InChIInChI=1S/C10H18N2O/c1-12-5-2-3-9(7-12)11-10-4-6-13-8-10/h8-9,11H,2-7H2,1H3
InChIKeyJVJICVXZGQSROA-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.93
Rot. Bonds2

About N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine

N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine (PubChem CID 175885568) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine.

Molecular Properties

Compound NameN-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine
PubChem CID175885568
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC NameN-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine
SMILESCN1CCCC(NC2=COCC2)C1
InChIInChI=1S/C10H18N2O/c1-12-5-2-3-9(7-12)11-10-4-6-13-8-10/h8-9,11H,2-7H2,1H3
InChIKeyJVJICVXZGQSROA-UHFFFAOYSA-N
XLogP0.93
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine?
The IUPAC name of N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine (CID 175885568) is N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine.
What is the SMILES notation for N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine?
The canonical SMILES for N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine is CN1CCCC(NC2=COCC2)C1.
What is the InChIKey of N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine?
The InChIKey is JVJICVXZGQSROA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-12-5-2-3-9(7-12)11-10-4-6-13-8-10/h8-9,11H,2-7H2,1H3.
What are the key properties of N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine?
N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine has a molecular weight of 182.27 g/mol, XLogP of 0.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydrofuran-4-yl)-1-methylpiperidin-3-amine is sourced from PubChem (CID 175885568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).