4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine

C14H12N2O — CID 166627502

IUPAC4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine
SMILESCc1cc(-c2ccc3occc3c2)cc(N)n1
InChIInChI=1S/C14H12N2O/c1-9-6-12(8-14(15)16-9)10-2-3-13-11(7-10)4-5-17-13/h2-8H,1H3,(H2,15,16)
InChIKeyKRISPNUBEOGQRR-UHFFFAOYSA-N
MW224.26 g/mol
LogP3.39
Rot. Bonds1

About 4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine

4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine (PubChem CID 166627502) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine.

Molecular Properties

Compound Name4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine
PubChem CID166627502
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine
SMILESCc1cc(-c2ccc3occc3c2)cc(N)n1
InChIInChI=1S/C14H12N2O/c1-9-6-12(8-14(15)16-9)10-2-3-13-11(7-10)4-5-17-13/h2-8H,1H3,(H2,15,16)
InChIKeyKRISPNUBEOGQRR-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-Amino-4-(2-furyl)-6-phenylnicotinonitrile
CID 743242
4-(2,3-Dimethyl-1-benzofuran-5-yl)pyridine-2,6-diamine
CID 155920140
4-(1-Benzofuran-5-yl)pyridine-2,6-diamine
CID 155920134
4-(1-Benzofuran-5-yl)pyridin-2-amine
CID 155920136
N-[6-amino-4-(1-benzofuran-5-yl)-2-pyridinyl]-2-(methylamino)acetamide
CID 155920138
4-(2-Methyl-1-benzofuran-5-yl)pyridine-2,6-diamine
CID 155920139
N-[3-cyano-4-(furan-2-yl)-6-phenylpyridin-2-yl]acetamide
CID 671422
2-Amino-4-(5-methyl-2-furyl)-6-phenylnicotinonitrile
CID 3355257
2-Amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile
CID 659053
2-Amino-5-ethyl-4-(2-furanyl)-6-propyl-3-pyridinecarbonitrile
CID 748950
2-amino-4-(2-furyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
CID 754321
2-Amino-5-butyl-4-(furan-2-yl)-6-pentylpyridine-3-carbonitrile
CID 1897510

Frequently Asked Questions

What is the IUPAC name of 4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine?
The IUPAC name of 4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine (CID 166627502) is 4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine.
What is the SMILES notation for 4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine?
The canonical SMILES for 4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine is Cc1cc(-c2ccc3occc3c2)cc(N)n1.
What is the InChIKey of 4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine?
The InChIKey is KRISPNUBEOGQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c1-9-6-12(8-14(15)16-9)10-2-3-13-11(7-10)4-5-17-13/h2-8H,1H3,(H2,15,16).
What are the key properties of 4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine?
4-(1-benzofuran-5-yl)-6-methylpyridin-2-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 4-(1-benzofuran-5-yl)-6-methylpyridin-2-amine is sourced from PubChem (CID 166627502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).