N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine

C12H20N2O — CID 62428197

IUPACN-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine
SMILESCNCc1coc(CN2CCC(C)C2)c1
InChIInChI=1S/C12H20N2O/c1-10-3-4-14(7-10)8-12-5-11(6-13-2)9-15-12/h5,9-10,13H,3-4,6-8H2,1-2H3
InChIKeyATGQJOZAGVHXBF-UHFFFAOYSA-N
MW208.30 g/mol
LogP1.84
Rot. Bonds4

About N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine

N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine (PubChem CID 62428197) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine
PubChem CID62428197
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC NameN-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine
SMILESCNCc1coc(CN2CCC(C)C2)c1
InChIInChI=1S/C12H20N2O/c1-10-3-4-14(7-10)8-12-5-11(6-13-2)9-15-12/h5,9-10,13H,3-4,6-8H2,1-2H3
InChIKeyATGQJOZAGVHXBF-UHFFFAOYSA-N
XLogP1.84
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine with MolForge

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

Launch Full Analysis

Related Compounds

1-[5-[(4-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine
CID 62412564
1-[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine
CID 62432874
1-[5-[(4,4-dimethylpiperidin-1-yl)methyl]furan-3-yl]-N-methylmethanamine
CID 62932027
N-[[5-[(4-methylpiperidin-1-yl)methyl]furan-3-yl]methyl]propan-2-amine
CID 55069819
N-methyl-1-[3-[(3-methylpiperidin-1-yl)methyl]phenyl]methanamine
CID 62439444
N-[[5-[(2-methyl-1,4-oxazepan-4-yl)methyl]furan-3-yl]methyl]cyclopropanamine
CID 62974113
N-methyl-1-[5-methyl-4-[(3-methylpyrrolidin-1-yl)methyl]thiophen-2-yl]methanamine
CID 80728289
1-[[4-[(cyclopropylamino)methyl]furan-2-yl]methyl]-N,N-dimethylpiperidin-4-amine
CID 62432280
1-[5-[(5-ethyl-2-methylmorpholin-4-yl)methyl]furan-3-yl]-N-methylmethanamine
CID 62461076
N-[[5-[(4-tert-butylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine
CID 62411943
N-[[5-[(3-ethylpiperidin-1-yl)methyl]furan-3-yl]methyl]propan-2-amine
CID 62433044
2-methyl-N-[[5-[(2-methylmorpholin-4-yl)methyl]furan-3-yl]methyl]propan-1-amine
CID 62439121

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine?
The IUPAC name of N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine (CID 62428197) is N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine is CNCc1coc(CN2CCC(C)C2)c1.
What is the InChIKey of N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine?
The InChIKey is ATGQJOZAGVHXBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-10-3-4-14(7-10)8-12-5-11(6-13-2)9-15-12/h5,9-10,13H,3-4,6-8H2,1-2H3.
What are the key properties of N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine?
N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine has a molecular weight of 208.30 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-[(3-methylpyrrolidin-1-yl)methyl]furan-3-yl]methanamine is sourced from PubChem (CID 62428197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).