3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide

C18H24N2O — CID 68541371

IUPAC3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide
SMILESNC(=O)CCC1=CN(C2CCCCC2)c2ccccc2C1
InChIInChI=1S/C18H24N2O/c19-18(21)11-10-14-12-15-6-4-5-9-17(15)20(13-14)16-7-2-1-3-8-16/h4-6,9,13,16H,1-3,7-8,10-12H2,(H2,19,21)
InChIKeyUKTCSQKESKXSNG-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.53
Rot. Bonds4

About 3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide

3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide (PubChem CID 68541371) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide.

Molecular Properties

Compound Name3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide
PubChem CID68541371
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide
SMILESNC(=O)CCC1=CN(C2CCCCC2)c2ccccc2C1
InChIInChI=1S/C18H24N2O/c19-18(21)11-10-14-12-15-6-4-5-9-17(15)20(13-14)16-7-2-1-3-8-16/h4-6,9,13,16H,1-3,7-8,10-12H2,(H2,19,21)
InChIKeyUKTCSQKESKXSNG-UHFFFAOYSA-N
XLogP3.53
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide?
The IUPAC name of 3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide (CID 68541371) is 3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide.
What is the SMILES notation for 3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide?
The canonical SMILES for 3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide is NC(=O)CCC1=CN(C2CCCCC2)c2ccccc2C1.
What is the InChIKey of 3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide?
The InChIKey is UKTCSQKESKXSNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c19-18(21)11-10-14-12-15-6-4-5-9-17(15)20(13-14)16-7-2-1-3-8-16/h4-6,9,13,16H,1-3,7-8,10-12H2,(H2,19,21).
What are the key properties of 3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide?
3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide has a molecular weight of 284.40 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclohexyl-4H-quinolin-3-yl)propanamide is sourced from PubChem (CID 68541371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).