N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine

C10H16N2O — CID 115118775

IUPACN-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine
SMILESCc1ccc(N(C)C2CCNC2)o1
InChIInChI=1S/C10H16N2O/c1-8-3-4-10(13-8)12(2)9-5-6-11-7-9/h3-4,9,11H,5-7H2,1-2H3
InChIKeyTXWMVCVLIRYLJI-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.39
Rot. Bonds2

About N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine

N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine (PubChem CID 115118775) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine
PubChem CID115118775
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC NameN-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine
SMILESCc1ccc(N(C)C2CCNC2)o1
InChIInChI=1S/C10H16N2O/c1-8-3-4-10(13-8)12(2)9-5-6-11-7-9/h3-4,9,11H,5-7H2,1-2H3
InChIKeyTXWMVCVLIRYLJI-UHFFFAOYSA-N
XLogP1.39
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(5-methylfuran-2-yl)-2-piperidin-3-ylacetamide
CID 115160587
N,3-dimethyl-N-pyrrolidin-3-ylquinoxalin-2-amine
CID 55205906
N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine
CID 78989080
N-methyl-N-(4-nitrophenyl)pyrrolidin-3-amine
CID 63301700
3-(5-methylfuran-2-yl)pyrrolidine
CID 62066693
N-(4-tert-butyl-2-methylphenyl)-N-methylpyrrolidin-3-amine
CID 115118753
N-methyl-N-thiophen-2-ylpyrrolidin-3-amine
CID 115118676
N-methyl-N-(4-propylphenyl)pyrrolidin-3-amine
CID 115118684
N-(5-chlorothiophen-2-yl)-N-methylpyrrolidin-3-amine
CID 115118693
N-methyl-N-(2-methyl-5-propan-2-ylphenyl)pyrrolidin-3-amine
CID 115118743
N,4-dimethyl-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine;hydrochloride
CID 71640984
N-methyl-N-(5-methylfuran-2-yl)-2-(1-methylpiperazin-2-yl)acetamide
CID 115178391

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine?
The IUPAC name of N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine (CID 115118775) is N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine.
What is the SMILES notation for N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine?
The canonical SMILES for N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine is Cc1ccc(N(C)C2CCNC2)o1.
What is the InChIKey of N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine?
The InChIKey is TXWMVCVLIRYLJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-8-3-4-10(13-8)12(2)9-5-6-11-7-9/h3-4,9,11H,5-7H2,1-2H3.
What are the key properties of N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine?
N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine has a molecular weight of 180.25 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine is sourced from PubChem (CID 115118775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).