N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine

C14H15N3O — CID 57391890

IUPACN-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine
SMILESCNCc1ccc(-c2nn(C)c3ccccc23)o1
InChIInChI=1S/C14H15N3O/c1-15-9-10-7-8-13(18-10)14-11-5-3-4-6-12(11)17(2)16-14/h3-8,15H,9H2,1-2H3
InChIKeyJVWUJLHXHXHUDJ-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.55
Rot. Bonds3

About N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine

N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine (PubChem CID 57391890) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine
PubChem CID57391890
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine
SMILESCNCc1ccc(-c2nn(C)c3ccccc23)o1
InChIInChI=1S/C14H15N3O/c1-15-9-10-7-8-13(18-10)14-11-5-3-4-6-12(11)17(2)16-14/h3-8,15H,9H2,1-2H3
InChIKeyJVWUJLHXHXHUDJ-UHFFFAOYSA-N
XLogP2.55
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine?
The IUPAC name of N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine (CID 57391890) is N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine is CNCc1ccc(-c2nn(C)c3ccccc23)o1.
What is the InChIKey of N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine?
The InChIKey is JVWUJLHXHXHUDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-15-9-10-7-8-13(18-10)14-11-5-3-4-6-12(11)17(2)16-14/h3-8,15H,9H2,1-2H3.
What are the key properties of N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine?
N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine has a molecular weight of 241.29 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine is sourced from PubChem (CID 57391890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).