N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide

C17H20N2O — CID 524050

IUPACN-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide
SMILESCC(=O)N(C)CCC(c1ccccc1)c1ccccn1
InChIInChI=1S/C17H20N2O/c1-14(20)19(2)13-11-16(15-8-4-3-5-9-15)17-10-6-7-12-18-17/h3-10,12,16H,11,13H2,1-2H3
InChIKeyVLRZUFDFIGKGCN-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.08
Rot. Bonds5

About N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide

N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide (PubChem CID 524050) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide.

Molecular Properties

Compound NameN-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide
PubChem CID524050
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC NameN-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide
SMILESCC(=O)N(C)CCC(c1ccccc1)c1ccccn1
InChIInChI=1S/C17H20N2O/c1-14(20)19(2)13-11-16(15-8-4-3-5-9-15)17-10-6-7-12-18-17/h3-10,12,16H,11,13H2,1-2H3
InChIKeyVLRZUFDFIGKGCN-UHFFFAOYSA-N
XLogP3.08
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide?
The IUPAC name of N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide (CID 524050) is N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide.
What is the SMILES notation for N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide?
The canonical SMILES for N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide is CC(=O)N(C)CCC(c1ccccc1)c1ccccn1.
What is the InChIKey of N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide?
The InChIKey is VLRZUFDFIGKGCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-14(20)19(2)13-11-16(15-8-4-3-5-9-15)17-10-6-7-12-18-17/h3-10,12,16H,11,13H2,1-2H3.
What are the key properties of N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide?
N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide has a molecular weight of 268.36 g/mol, XLogP of 3.08, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-phenyl-3-pyridin-2-ylpropyl)acetamide is sourced from PubChem (CID 524050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).