N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide

C19H24N2O2 — CID 655706

IUPACN-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide
SMILESCCC(=O)N(Cc1cc(=O)[nH]c2ccccc12)C1CCCCC1
InChIInChI=1S/C19H24N2O2/c1-2-19(23)21(15-8-4-3-5-9-15)13-14-12-18(22)20-17-11-7-6-10-16(14)17/h6-7,10-12,15H,2-5,8-9,13H2,1H3,(H,20,22)
InChIKeyVYTLURRAPHRIAX-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.60
Rot. Bonds4

About N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide

N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide (PubChem CID 655706) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide.

Molecular Properties

Compound NameN-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide
PubChem CID655706
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide
SMILESCCC(=O)N(Cc1cc(=O)[nH]c2ccccc12)C1CCCCC1
InChIInChI=1S/C19H24N2O2/c1-2-19(23)21(15-8-4-3-5-9-15)13-14-12-18(22)20-17-11-7-6-10-16(14)17/h6-7,10-12,15H,2-5,8-9,13H2,1H3,(H,20,22)
InChIKeyVYTLURRAPHRIAX-UHFFFAOYSA-N
XLogP3.60
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide?
The IUPAC name of N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide (CID 655706) is N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide.
What is the SMILES notation for N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide?
The canonical SMILES for N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide is CCC(=O)N(Cc1cc(=O)[nH]c2ccccc12)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide?
The InChIKey is VYTLURRAPHRIAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-2-19(23)21(15-8-4-3-5-9-15)13-14-12-18(22)20-17-11-7-6-10-16(14)17/h6-7,10-12,15H,2-5,8-9,13H2,1H3,(H,20,22).
What are the key properties of N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide?
N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide has a molecular weight of 312.41 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide is sourced from PubChem (CID 655706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).