2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine

C14H12N2O — CID 114731846

IUPAC2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine
SMILESCc1cccc2cc(-c3cc(N)ccn3)oc12
InChIInChI=1S/C14H12N2O/c1-9-3-2-4-10-7-13(17-14(9)10)12-8-11(15)5-6-16-12/h2-8H,1H3,(H2,15,16)
InChIKeyLTLGBOXQVCTZAP-UHFFFAOYSA-N
MW224.26 g/mol
LogP3.39
Rot. Bonds1

About 2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine

2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine (PubChem CID 114731846) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine.

Molecular Properties

Compound Name2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine
PubChem CID114731846
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine
SMILESCc1cccc2cc(-c3cc(N)ccn3)oc12
InChIInChI=1S/C14H12N2O/c1-9-3-2-4-10-7-13(17-14(9)10)12-8-11(15)5-6-16-12/h2-8H,1H3,(H2,15,16)
InChIKeyLTLGBOXQVCTZAP-UHFFFAOYSA-N
XLogP3.39
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(7-methoxy-1-benzofuran-2-yl)pyridin-4-amine
CID 115113768
2-[7-(trifluoromethyl)-1-benzofuran-2-yl]pyridin-4-amine
CID 115113737
4-(7-methyl-1-benzofuran-2-yl)-N-propylpyrimidin-2-amine
CID 114734607
5,6-dimethyl-3-(7-methyl-1-benzofuran-2-yl)pyrazin-2-amine
CID 114734623
6-(7-chloro-1-benzofuran-2-yl)-4-methylpyridin-3-amine
CID 114256473
6-(7-methyl-1-benzofuran-2-yl)-5-propan-2-ylpyrimidin-4-amine
CID 114734652
5-methyl-6-(7-methyl-1-benzofuran-2-yl)-2-propylpyrimidin-4-amine
CID 114734621
[2-(7-fluoro-1-benzofuran-2-yl)-4-pyridinyl]methanamine
CID 115113748
4-(7-methoxy-1-benzofuran-2-yl)pyrimidin-2-amine
CID 1480563
3,6-dichloro-4-(7-methyl-1-benzofuran-2-yl)pyridazine
CID 114734145
(7-methyl-1-benzofuran-2-yl)-(2-methyl-4-pyridinyl)methanamine
CID 106755901
tris(2-(4-amino-2-pyridinyl)pyridin-4-amine);ruthenium(2+);dichloride
CID 154703049

Frequently Asked Questions

What is the IUPAC name of 2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine?
The IUPAC name of 2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine (CID 114731846) is 2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine.
What is the SMILES notation for 2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine?
The canonical SMILES for 2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine is Cc1cccc2cc(-c3cc(N)ccn3)oc12.
What is the InChIKey of 2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine?
The InChIKey is LTLGBOXQVCTZAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c1-9-3-2-4-10-7-13(17-14(9)10)12-8-11(15)5-6-16-12/h2-8H,1H3,(H2,15,16).
What are the key properties of 2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine?
2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine has a molecular weight of 224.26 g/mol, XLogP of 3.39, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methyl-1-benzofuran-2-yl)pyridin-4-amine is sourced from PubChem (CID 114731846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).