N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine

C11H12N2O — CID 119021959

IUPACN-methyl-N-(pyridin-4-ylmethyl)furan-2-amine
SMILESCN(Cc1ccncc1)c1ccco1
InChIInChI=1S/C11H12N2O/c1-13(11-3-2-8-14-11)9-10-4-6-12-7-5-10/h2-8H,9H2,1H3
InChIKeyGMXALYCOUNZBQR-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.31
Rot. Bonds3

About N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine

N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine (PubChem CID 119021959) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine.

Molecular Properties

Compound NameN-methyl-N-(pyridin-4-ylmethyl)furan-2-amine
PubChem CID119021959
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC NameN-methyl-N-(pyridin-4-ylmethyl)furan-2-amine
SMILESCN(Cc1ccncc1)c1ccco1
InChIInChI=1S/C11H12N2O/c1-13(11-3-2-8-14-11)9-10-4-6-12-7-5-10/h2-8H,9H2,1H3
InChIKeyGMXALYCOUNZBQR-UHFFFAOYSA-N
XLogP2.31
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine?
The IUPAC name of N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine (CID 119021959) is N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine.
What is the SMILES notation for N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine?
The canonical SMILES for N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine is CN(Cc1ccncc1)c1ccco1.
What is the InChIKey of N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine?
The InChIKey is GMXALYCOUNZBQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-13(11-3-2-8-14-11)9-10-4-6-12-7-5-10/h2-8H,9H2,1H3.
What are the key properties of N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine?
N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine has a molecular weight of 188.23 g/mol, XLogP of 2.31, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(pyridin-4-ylmethyl)furan-2-amine is sourced from PubChem (CID 119021959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).