N-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide

C18H18ClNO — CID 57367362

IUPACN-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide
SMILESO=CN(c1cccc(Cl)c1)C1(c2ccccc2)CCCC1
InChIInChI=1S/C18H18ClNO/c19-16-9-6-10-17(13-16)20(14-21)18(11-4-5-12-18)15-7-2-1-3-8-15/h1-3,6-10,13-14H,4-5,11-12H2
InChIKeyZZOFJTWSNKEBNU-UHFFFAOYSA-N
MW299.80 g/mol
LogP4.77
Rot. Bonds4

About N-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide

N-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide (PubChem CID 57367362) has the molecular formula C18H18ClNO and a molecular weight of 299.80 g/mol. Its IUPAC name is N-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide
PubChem CID57367362
Molecular FormulaC18H18ClNO
Molecular Weight299.80 g/mol
Exact Mass299.11
IUPAC NameN-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide
SMILESO=CN(c1cccc(Cl)c1)C1(c2ccccc2)CCCC1
InChIInChI=1S/C18H18ClNO/c19-16-9-6-10-17(13-16)20(14-21)18(11-4-5-12-18)15-7-2-1-3-8-15/h1-3,6-10,13-14H,4-5,11-12H2
InChIKeyZZOFJTWSNKEBNU-UHFFFAOYSA-N
XLogP4.77
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.80
LogP ≤ 54.77
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-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide?
The IUPAC name of N-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide (CID 57367362) is N-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide.
What is the SMILES notation for N-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide?
The canonical SMILES for N-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide is O=CN(c1cccc(Cl)c1)C1(c2ccccc2)CCCC1.
What is the InChIKey of N-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide?
The InChIKey is ZZOFJTWSNKEBNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClNO/c19-16-9-6-10-17(13-16)20(14-21)18(11-4-5-12-18)15-7-2-1-3-8-15/h1-3,6-10,13-14H,4-5,11-12H2.
What are the key properties of N-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide?
N-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide has a molecular weight of 299.80 g/mol, XLogP of 4.77, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-N-(1-phenylcyclopentyl)formamide is sourced from PubChem (CID 57367362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).