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

C15H17N3O — CID 57393622

IUPACN,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine
SMILESCN(C)Cc1ccc(-c2nn(C)c3ccccc23)o1
InChIInChI=1S/C15H17N3O/c1-17(2)10-11-8-9-14(19-11)15-12-6-4-5-7-13(12)18(3)16-15/h4-9H,10H2,1-3H3
InChIKeyMQDLXEYYKJYJQF-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.89
Rot. Bonds3

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

N,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine (PubChem CID 57393622) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine
PubChem CID57393622
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine
SMILESCN(C)Cc1ccc(-c2nn(C)c3ccccc23)o1
InChIInChI=1S/C15H17N3O/c1-17(2)10-11-8-9-14(19-11)15-12-6-4-5-7-13(12)18(3)16-15/h4-9H,10H2,1-3H3
InChIKeyMQDLXEYYKJYJQF-UHFFFAOYSA-N
XLogP2.89
TPSA34.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine?
The IUPAC name of N,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine (CID 57393622) is N,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine is CN(C)Cc1ccc(-c2nn(C)c3ccccc23)o1.
What is the InChIKey of N,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine?
The InChIKey is MQDLXEYYKJYJQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-17(2)10-11-8-9-14(19-11)15-12-6-4-5-7-13(12)18(3)16-15/h4-9H,10H2,1-3H3.
What are the key properties of N,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine?
N,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine has a molecular weight of 255.32 g/mol, XLogP of 2.89, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[5-(1-methylindazol-3-yl)furan-2-yl]methanamine is sourced from PubChem (CID 57393622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).