N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide

C19H17ClF3NO — CID 57367348

IUPACN-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide
SMILESO=CN(c1ccc(Cl)cc1C(F)(F)F)C1(c2ccccc2)CCCC1
InChIInChI=1S/C19H17ClF3NO/c20-15-8-9-17(16(12-15)19(21,22)23)24(13-25)18(10-4-5-11-18)14-6-2-1-3-7-14/h1-3,6-9,12-13H,4-5,10-11H2
InChIKeyVXPPQGBCJAMOSQ-UHFFFAOYSA-N
MW367.80 g/mol
LogP5.79
Rot. Bonds4

About N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide

N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide (PubChem CID 57367348) has the molecular formula C19H17ClF3NO and a molecular weight of 367.80 g/mol. Its IUPAC name is N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide.

Molecular Properties

Compound NameN-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide
PubChem CID57367348
Molecular FormulaC19H17ClF3NO
Molecular Weight367.80 g/mol
Exact Mass367.10
IUPAC NameN-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide
SMILESO=CN(c1ccc(Cl)cc1C(F)(F)F)C1(c2ccccc2)CCCC1
InChIInChI=1S/C19H17ClF3NO/c20-15-8-9-17(16(12-15)19(21,22)23)24(13-25)18(10-4-5-11-18)14-6-2-1-3-7-14/h1-3,6-9,12-13H,4-5,10-11H2
InChIKeyVXPPQGBCJAMOSQ-UHFFFAOYSA-N
XLogP5.79
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.80
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide?
The IUPAC name of N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide (CID 57367348) is N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide.
What is the SMILES notation for N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide?
The canonical SMILES for N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide is O=CN(c1ccc(Cl)cc1C(F)(F)F)C1(c2ccccc2)CCCC1.
What is the InChIKey of N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide?
The InChIKey is VXPPQGBCJAMOSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClF3NO/c20-15-8-9-17(16(12-15)19(21,22)23)24(13-25)18(10-4-5-11-18)14-6-2-1-3-7-14/h1-3,6-9,12-13H,4-5,10-11H2.
What are the key properties of N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide?
N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide has a molecular weight of 367.80 g/mol, XLogP of 5.79, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(1-phenylcyclopentyl)formamide is sourced from PubChem (CID 57367348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).