N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide

C18H26N2O — CID 46682613

IUPACN-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide
SMILESO=C(CCN1CCCc2ccccc21)NC1CCCCC1
InChIInChI=1S/C18H26N2O/c21-18(19-16-9-2-1-3-10-16)12-14-20-13-6-8-15-7-4-5-11-17(15)20/h4-5,7,11,16H,1-3,6,8-10,12-14H2,(H,19,21)
InChIKeyMVULQCLNWNITMJ-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.28
Rot. Bonds4

About N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide

N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide (PubChem CID 46682613) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide
PubChem CID46682613
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide
SMILESO=C(CCN1CCCc2ccccc21)NC1CCCCC1
InChIInChI=1S/C18H26N2O/c21-18(19-16-9-2-1-3-10-16)12-14-20-13-6-8-15-7-4-5-11-17(15)20/h4-5,7,11,16H,1-3,6,8-10,12-14H2,(H,19,21)
InChIKeyMVULQCLNWNITMJ-UHFFFAOYSA-N
XLogP3.28
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide?
The IUPAC name of N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide (CID 46682613) is N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide.
What is the SMILES notation for N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide?
The canonical SMILES for N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide is O=C(CCN1CCCc2ccccc21)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide?
The InChIKey is MVULQCLNWNITMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c21-18(19-16-9-2-1-3-10-16)12-14-20-13-6-8-15-7-4-5-11-17(15)20/h4-5,7,11,16H,1-3,6,8-10,12-14H2,(H,19,21).
What are the key properties of N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide?
N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide has a molecular weight of 286.42 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide is sourced from PubChem (CID 46682613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).