N,N-bis(1-phenylethyl)formamide

C17H19NO — CID 85204972

IUPACN,N-bis(1-phenylethyl)formamide
SMILESCC(c1ccccc1)N(C=O)C(C)c1ccccc1
InChIInChI=1S/C17H19NO/c1-14(16-9-5-3-6-10-16)18(13-19)15(2)17-11-7-4-8-12-17/h3-15H,1-2H3
InChIKeyFDPSAOFMNCFKOH-UHFFFAOYSA-N
MW253.35 g/mol
LogP3.97
Rot. Bonds5

About N,N-bis(1-phenylethyl)formamide

N,N-bis(1-phenylethyl)formamide (PubChem CID 85204972) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is N,N-bis(1-phenylethyl)formamide.

Molecular Properties

Compound NameN,N-bis(1-phenylethyl)formamide
PubChem CID85204972
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC NameN,N-bis(1-phenylethyl)formamide
SMILESCC(c1ccccc1)N(C=O)C(C)c1ccccc1
InChIInChI=1S/C17H19NO/c1-14(16-9-5-3-6-10-16)18(13-19)15(2)17-11-7-4-8-12-17/h3-15H,1-2H3
InChIKeyFDPSAOFMNCFKOH-UHFFFAOYSA-N
XLogP3.97
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.97
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,N-bis(1-phenylethyl)formamide?
The IUPAC name of N,N-bis(1-phenylethyl)formamide (CID 85204972) is N,N-bis(1-phenylethyl)formamide.
What is the SMILES notation for N,N-bis(1-phenylethyl)formamide?
The canonical SMILES for N,N-bis(1-phenylethyl)formamide is CC(c1ccccc1)N(C=O)C(C)c1ccccc1.
What is the InChIKey of N,N-bis(1-phenylethyl)formamide?
The InChIKey is FDPSAOFMNCFKOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-14(16-9-5-3-6-10-16)18(13-19)15(2)17-11-7-4-8-12-17/h3-15H,1-2H3.
What are the key properties of N,N-bis(1-phenylethyl)formamide?
N,N-bis(1-phenylethyl)formamide has a molecular weight of 253.35 g/mol, XLogP of 3.97, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(1-phenylethyl)formamide is sourced from PubChem (CID 85204972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).