N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide

C17H26N2O — CID 60647843

IUPACN-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide
SMILESCc1ccccc1CNC(C)C(=O)NC1CCCCC1
InChIInChI=1S/C17H26N2O/c1-13-8-6-7-9-15(13)12-18-14(2)17(20)19-16-10-4-3-5-11-16/h6-9,14,16,18H,3-5,10-12H2,1-2H3,(H,19,20)
InChIKeyFEZXRCXIFNPGMI-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.92
Rot. Bonds5

About N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide

N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide (PubChem CID 60647843) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide
PubChem CID60647843
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide
SMILESCc1ccccc1CNC(C)C(=O)NC1CCCCC1
InChIInChI=1S/C17H26N2O/c1-13-8-6-7-9-15(13)12-18-14(2)17(20)19-16-10-4-3-5-11-16/h6-9,14,16,18H,3-5,10-12H2,1-2H3,(H,19,20)
InChIKeyFEZXRCXIFNPGMI-UHFFFAOYSA-N
XLogP2.92
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide?
The IUPAC name of N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide (CID 60647843) is N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide.
What is the SMILES notation for N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide?
The canonical SMILES for N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide is Cc1ccccc1CNC(C)C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide?
The InChIKey is FEZXRCXIFNPGMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-13-8-6-7-9-15(13)12-18-14(2)17(20)19-16-10-4-3-5-11-16/h6-9,14,16,18H,3-5,10-12H2,1-2H3,(H,19,20).
What are the key properties of N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide?
N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide has a molecular weight of 274.41 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[(2-methylphenyl)methylamino]propanamide is sourced from PubChem (CID 60647843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).