2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide

C16H16N4O2 — CID 51085889

IUPAC2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide
SMILESCc1ccc(CN(C)C(=O)c2ccnc(-n3ccnc3)c2)o1
InChIInChI=1S/C16H16N4O2/c1-12-3-4-14(22-12)10-19(2)16(21)13-5-6-18-15(9-13)20-8-7-17-11-20/h3-9,11H,10H2,1-2H3
InChIKeyNOIOXCZXMWXCHN-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.44
Rot. Bonds4

About 2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide

2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide (PubChem CID 51085889) has the molecular formula C16H16N4O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is 2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide
PubChem CID51085889
Molecular FormulaC16H16N4O2
Molecular Weight296.33 g/mol
Exact Mass296.13
IUPAC Name2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide
SMILESCc1ccc(CN(C)C(=O)c2ccnc(-n3ccnc3)c2)o1
InChIInChI=1S/C16H16N4O2/c1-12-3-4-14(22-12)10-19(2)16(21)13-5-6-18-15(9-13)20-8-7-17-11-20/h3-9,11H,10H2,1-2H3
InChIKeyNOIOXCZXMWXCHN-UHFFFAOYSA-N
XLogP2.44
TPSA64.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-imidazol-1-yl-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
CID 51089957
2-(cyanomethyl)-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide
CID 115116232
3,4-diethoxy-N-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 78768450
N-cyclobutyl-N-(cyclopropylmethyl)-2-imidazol-1-ylpyridine-4-carboxamide
CID 166222406
N-methyl-N-[(5-methylfuran-2-yl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 7535670
2-N,5-N-dimethyl-2-N,5-N-bis[(5-methylfuran-2-yl)methyl]thiophene-2,5-dicarboxamide
CID 56809035
N-[(2R)-4-(furan-2-yl)butan-2-yl]-2-imidazol-1-ylpyridine-4-carboxamide
CID 94816789
N-[4-(diethylamino)-4-oxobutyl]-2-imidazol-1-ylpyridine-4-carboxamide
CID 51090160
4-carbamothioyl-N-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 43519484
3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
CID 113447596
N-(2,3-dihydro-1H-inden-1-yl)-2-imidazol-1-yl-N-methylpyridine-4-carboxamide
CID 51085905
3-fluoro-4-methoxy-N-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 86906483

Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide?
The IUPAC name of 2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide (CID 51085889) is 2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide is Cc1ccc(CN(C)C(=O)c2ccnc(-n3ccnc3)c2)o1.
What is the InChIKey of 2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide?
The InChIKey is NOIOXCZXMWXCHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2/c1-12-3-4-14(22-12)10-19(2)16(21)13-5-6-18-15(9-13)20-8-7-17-11-20/h3-9,11H,10H2,1-2H3.
What are the key properties of 2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide?
2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide has a molecular weight of 296.33 g/mol, XLogP of 2.44, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 51085889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).