N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide

C19H24N4O2 — CID 51099740

IUPACN-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide
SMILESO=C(CNC(=O)NCc1cccc2cccnc12)NC1CCCCC1
InChIInChI=1S/C19H24N4O2/c24-17(23-16-9-2-1-3-10-16)13-22-19(25)21-12-15-7-4-6-14-8-5-11-20-18(14)15/h4-8,11,16H,1-3,9-10,12-13H2,(H,23,24)(H2,21,22,25)
InChIKeyUQADOUXGUXQLIZ-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.48
Rot. Bonds5

About N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide

N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide (PubChem CID 51099740) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide
PubChem CID51099740
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide
SMILESO=C(CNC(=O)NCc1cccc2cccnc12)NC1CCCCC1
InChIInChI=1S/C19H24N4O2/c24-17(23-16-9-2-1-3-10-16)13-22-19(25)21-12-15-7-4-6-14-8-5-11-20-18(14)15/h4-8,11,16H,1-3,9-10,12-13H2,(H,23,24)(H2,21,22,25)
InChIKeyUQADOUXGUXQLIZ-UHFFFAOYSA-N
XLogP2.48
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide?
The IUPAC name of N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide (CID 51099740) is N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide?
The canonical SMILES for N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide is O=C(CNC(=O)NCc1cccc2cccnc12)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide?
The InChIKey is UQADOUXGUXQLIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c24-17(23-16-9-2-1-3-10-16)13-22-19(25)21-12-15-7-4-6-14-8-5-11-20-18(14)15/h4-8,11,16H,1-3,9-10,12-13H2,(H,23,24)(H2,21,22,25).
What are the key properties of N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide?
N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide has a molecular weight of 340.43 g/mol, XLogP of 2.48, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(quinolin-8-ylmethylcarbamoylamino)acetamide is sourced from PubChem (CID 51099740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).