N-[5-(4-methylphenyl)-4-phenylpentyl]formamide

C19H23NO — CID 155049356

IUPACN-[5-(4-methylphenyl)-4-phenylpentyl]formamide
SMILESCc1ccc(CC(CCCNC=O)c2ccccc2)cc1
InChIInChI=1S/C19H23NO/c1-16-9-11-17(12-10-16)14-19(8-5-13-20-15-21)18-6-3-2-4-7-18/h2-4,6-7,9-12,15,19H,5,8,13-14H2,1H3,(H,20,21)
InChIKeyMTUOFZSQNOANTJ-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.85
Rot. Bonds8

About N-[5-(4-methylphenyl)-4-phenylpentyl]formamide

N-[5-(4-methylphenyl)-4-phenylpentyl]formamide (PubChem CID 155049356) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N-[5-(4-methylphenyl)-4-phenylpentyl]formamide.

Molecular Properties

Compound NameN-[5-(4-methylphenyl)-4-phenylpentyl]formamide
PubChem CID155049356
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN-[5-(4-methylphenyl)-4-phenylpentyl]formamide
SMILESCc1ccc(CC(CCCNC=O)c2ccccc2)cc1
InChIInChI=1S/C19H23NO/c1-16-9-11-17(12-10-16)14-19(8-5-13-20-15-21)18-6-3-2-4-7-18/h2-4,6-7,9-12,15,19H,5,8,13-14H2,1H3,(H,20,21)
InChIKeyMTUOFZSQNOANTJ-UHFFFAOYSA-N
XLogP3.85
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-4-[3-(4-methylphenyl)-2-phenylpropyl]benzene
CID 91287342
N-(3-aminopropyl)formamide;toluene
CID 162755810
1-phenylundecan-2-ylbenzene
CID 22919994
1-phenyltridecan-2-ylbenzene
CID 22919631
4-(4-methylphenyl)-N-[3-(4-methylphenyl)-3-phenylpropyl]butan-1-amine
CID 159418056
3,4-bis(4-methylphenyl)butane-1-thiol
CID 175037833
5,6-diphenylhexan-2-one
CID 134938963
N-[4-[3-[benzyl-[3-[4-formamidobutyl-(4-methylphenyl)sulfonylamino]propyl]amino]propyl-(4-methylphenyl)sulfonylamino]butyl]formamide
CID 23242802
N-[(2S)-2-phenylbutyl]formamide
CID 124705740
2-[5-(4-methylphenyl)-6-phenylhexyl]furan
CID 156599733
N-methyl-2,3-bis(4-methylphenyl)propan-1-amine
CID 79437244
N-(6-phenylhexyl)formamide
CID 25180077

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-methylphenyl)-4-phenylpentyl]formamide?
The IUPAC name of N-[5-(4-methylphenyl)-4-phenylpentyl]formamide (CID 155049356) is N-[5-(4-methylphenyl)-4-phenylpentyl]formamide.
What is the SMILES notation for N-[5-(4-methylphenyl)-4-phenylpentyl]formamide?
The canonical SMILES for N-[5-(4-methylphenyl)-4-phenylpentyl]formamide is Cc1ccc(CC(CCCNC=O)c2ccccc2)cc1.
What is the InChIKey of N-[5-(4-methylphenyl)-4-phenylpentyl]formamide?
The InChIKey is MTUOFZSQNOANTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-16-9-11-17(12-10-16)14-19(8-5-13-20-15-21)18-6-3-2-4-7-18/h2-4,6-7,9-12,15,19H,5,8,13-14H2,1H3,(H,20,21).
What are the key properties of N-[5-(4-methylphenyl)-4-phenylpentyl]formamide?
N-[5-(4-methylphenyl)-4-phenylpentyl]formamide has a molecular weight of 281.40 g/mol, XLogP of 3.85, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-methylphenyl)-4-phenylpentyl]formamide is sourced from PubChem (CID 155049356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).