N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide

C15H13N3O2 — CID 115273817

IUPACN-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide
SMILESCN(C(=O)c1coc2ccccc12)c1ccc(N)cn1
InChIInChI=1S/C15H13N3O2/c1-18(14-7-6-10(16)8-17-14)15(19)12-9-20-13-5-3-2-4-11(12)13/h2-9H,16H2,1H3
InChIKeyXMBSJQLWGMNMKJ-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.69
Rot. Bonds2

About N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide

N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide (PubChem CID 115273817) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide.

Molecular Properties

Compound NameN-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide
PubChem CID115273817
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC NameN-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide
SMILESCN(C(=O)c1coc2ccccc12)c1ccc(N)cn1
InChIInChI=1S/C15H13N3O2/c1-18(14-7-6-10(16)8-17-14)15(19)12-9-20-13-5-3-2-4-11(12)13/h2-9H,16H2,1H3
InChIKeyXMBSJQLWGMNMKJ-UHFFFAOYSA-N
XLogP2.69
TPSA72.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-hydroxycyclopentyl)methyl]-N-methyl-1-benzofuran-3-carboxamide
CID 115760134
N',N'-dimethyl-1-benzofuran-3-carbohydrazide
CID 116848024
N-(5-amino-2-pyridinyl)-2,2,2-trifluoro-N-methylacetamide
CID 130646725
1-[1-benzofuran-3-carbonyl(methyl)amino]cyclohexane-1-carboxylic acid
CID 120539512
2-[1-benzofuran-3-carbonyl-[2-(dimethylamino)ethyl]amino]acetic acid
CID 103802927
5-amino-2-[methyl(sulfino)amino]pyridine
CID 175914292
1-benzofuran-3-yl-(1-methylcyclopropyl)methanone
CID 164656337
1-(1-benzofuran-3-yl)-2-hydroxypropan-1-one
CID 83697645
N-ethyl-N-prop-2-ynyl-1-benzofuran-3-carboxamide
CID 78959159
1-(1-benzofuran-3-yl)-2-[methyl(propan-2-yl)amino]ethanone
CID 43794594
4-(1-benzofuran-3-ylamino)-2-methylpyrimidine-5-carboxylic acid
CID 115148740
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methyl-1-benzofuran-3-carboxamide;hydrochloride
CID 86813060

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide?
The IUPAC name of N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide (CID 115273817) is N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide.
What is the SMILES notation for N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide?
The canonical SMILES for N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide is CN(C(=O)c1coc2ccccc12)c1ccc(N)cn1.
What is the InChIKey of N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide?
The InChIKey is XMBSJQLWGMNMKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-18(14-7-6-10(16)8-17-14)15(19)12-9-20-13-5-3-2-4-11(12)13/h2-9H,16H2,1H3.
What are the key properties of N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide?
N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-pyridinyl)-N-methyl-1-benzofuran-3-carboxamide is sourced from PubChem (CID 115273817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).