N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide

C97H120N16O15S2 — CID 157462510

IUPACN-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide
SMILESCNC(=O)C1CC1.CNC(=O)C1CCCC1.CNC(=O)C1CCCCC1.CNC(=O)c1ccc2ccccc2c1.CNC(=O)c1cccc2ccccc12.CNC(=O)c1ccccc1.CNC(=O)c1ccccn1.CNC(=O)c1cccnc1.CNC(=O)c1ccco1.CNC(=O)c1cccs1.CNC(=O)c1ccncc1.CNC(=O)c1ccoc1.CNC(=O)c1ccsc1
InChIInChI=1S/2C12H11NO.C8H15NO.C8H9NO.3C7H8N2O.C7H13NO.2C6H7NO2.2C6H7NOS.C5H9NO/c1-13-12(14)11-8-4-6-9-5-2-3-7-10(9)11;1-13-12(14)11-7-6-9-4-2-3-5-10(9)8-11;2*1-9-8(10)7-5-3-2-4-6-7;1-8-7(10)6-2-4-9-5-3-6;1-8-7(10)6-3-2-4-9-5-6;1-8-7(10)6-4-2-3-5-9-6;1-8-7(9)6-4-2-3-5-6;1-7-6(8)5-2-3-9-4-5;1-7-6(8)5-3-2-4-9-5;1-7-6(8)5-2-3-9-4-5;1-7-6(8)5-3-2-4-9-5;1-6-5(7)4-2-3-4/h2*2-8H,1H3,(H,13,14);7H,2-6H2,1H3,(H,9,10);2-6H,1H3,(H,9,10);3*2-5H,1H3,(H,8,10);6H,2-5H2,1H3,(H,8,9);4*2-4H,1H3,(H,7,8);4H,2-3H2,1H3,(H,6,7)
InChIKeyBUCAVBBKWWPXMP-UHFFFAOYSA-N
MW1814.26 g/mol
LogP12.64
Rot. Bonds13

About N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide

N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide (PubChem CID 157462510) has the molecular formula C97H120N16O15S2 and a molecular weight of 1814.26 g/mol. Its IUPAC name is N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide.

Molecular Properties

Compound NameN-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide
PubChem CID157462510
Molecular FormulaC97H120N16O15S2
Molecular Weight1814.26 g/mol
Exact Mass1812.86
IUPAC NameN-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide
SMILESCNC(=O)C1CC1.CNC(=O)C1CCCC1.CNC(=O)C1CCCCC1.CNC(=O)c1ccc2ccccc2c1.CNC(=O)c1cccc2ccccc12.CNC(=O)c1ccccc1.CNC(=O)c1ccccn1.CNC(=O)c1cccnc1.CNC(=O)c1ccco1.CNC(=O)c1cccs1.CNC(=O)c1ccncc1.CNC(=O)c1ccoc1.CNC(=O)c1ccsc1
InChIInChI=1S/2C12H11NO.C8H15NO.C8H9NO.3C7H8N2O.C7H13NO.2C6H7NO2.2C6H7NOS.C5H9NO/c1-13-12(14)11-8-4-6-9-5-2-3-7-10(9)11;1-13-12(14)11-7-6-9-4-2-3-5-10(9)8-11;2*1-9-8(10)7-5-3-2-4-6-7;1-8-7(10)6-2-4-9-5-3-6;1-8-7(10)6-3-2-4-9-5-6;1-8-7(10)6-4-2-3-5-9-6;1-8-7(9)6-4-2-3-5-6;1-7-6(8)5-2-3-9-4-5;1-7-6(8)5-3-2-4-9-5;1-7-6(8)5-2-3-9-4-5;1-7-6(8)5-3-2-4-9-5;1-6-5(7)4-2-3-4/h2*2-8H,1H3,(H,13,14);7H,2-6H2,1H3,(H,9,10);2-6H,1H3,(H,9,10);3*2-5H,1H3,(H,8,10);6H,2-5H2,1H3,(H,8,9);4*2-4H,1H3,(H,7,8);4H,2-3H2,1H3,(H,6,7)
InChIKeyBUCAVBBKWWPXMP-UHFFFAOYSA-N
XLogP12.64
TPSA443.25 Ų
H-Bond Donors13
H-Bond Acceptors20
Rotatable Bonds13
Heavy Atoms130
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001814.26
LogP ≤ 512.64
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1020

Analyze N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide?
The IUPAC name of N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide (CID 157462510) is N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide.
What is the SMILES notation for N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide?
The canonical SMILES for N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide is CNC(=O)C1CC1.CNC(=O)C1CCCC1.CNC(=O)C1CCCCC1.CNC(=O)c1ccc2ccccc2c1.CNC(=O)c1cccc2ccccc12.CNC(=O)c1ccccc1.CNC(=O)c1ccccn1.CNC(=O)c1cccnc1.CNC(=O)c1ccco1.CNC(=O)c1cccs1.CNC(=O)c1ccncc1.CNC(=O)c1ccoc1.CNC(=O)c1ccsc1.
What is the InChIKey of N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide?
The InChIKey is BUCAVBBKWWPXMP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H11NO.C8H15NO.C8H9NO.3C7H8N2O.C7H13NO.2C6H7NO2.2C6H7NOS.C5H9NO/c1-13-12(14)11-8-4-6-9-5-2-3-7-10(9)11;1-13-12(14)11-7-6-9-4-2-3-5-10(9)8-11;2*1-9-8(10)7-5-3-2-4-6-7;1-8-7(10)6-2-4-9-5-3-6;1-8-7(10)6-3-2-4-9-5-6;1-8-7(10)6-4-2-3-5-9-6;1-8-7(9)6-4-2-3-5-6;1-7-6(8)5-2-3-9-4-5;1-7-6(8)5-3-2-4-9-5;1-7-6(8)5-2-3-9-4-5;1-7-6(8)5-3-2-4-9-5;1-6-5(7)4-2-3-4/h2*2-8H,1H3,(H,13,14);7H,2-6H2,1H3,(H,9,10);2-6H,1H3,(H,9,10);3*2-5H,1H3,(H,8,10);6H,2-5H2,1H3,(H,8,9);4*2-4H,1H3,(H,7,8);4H,2-3H2,1H3,(H,6,7).
What are the key properties of N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide?
N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide has a molecular weight of 1814.26 g/mol, XLogP of 12.64, 13 rotatable bonds, 13 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylbenzamide;N-methylcyclohexanecarboxamide;N-methylcyclopentanecarboxamide;N-methylcyclopropanecarboxamide;N-methylfuran-2-carboxamide;N-methylfuran-3-carboxamide;N-methylnaphthalene-1-carboxamide;N-methylnaphthalene-2-carboxamide;N-methylpyridine-2-carboxamide;N-methylpyridine-3-carboxamide;N-methylpyridine-4-carboxamide;N-methylthiophene-2-carboxamide;N-methylthiophene-3-carboxamide is sourced from PubChem (CID 157462510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).