N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide

C15H20N2O — CID 174503151

IUPACN,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide
SMILESCC(C)C(=O)N(C)C1NCC=C1c1ccccc1
InChIInChI=1S/C15H20N2O/c1-11(2)15(18)17(3)14-13(9-10-16-14)12-7-5-4-6-8-12/h4-9,11,14,16H,10H2,1-3H3
InChIKeyFGZURBAQCWZUTR-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.11
Rot. Bonds3

About N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide

N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide (PubChem CID 174503151) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide.

Molecular Properties

Compound NameN,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide
PubChem CID174503151
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC NameN,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide
SMILESCC(C)C(=O)N(C)C1NCC=C1c1ccccc1
InChIInChI=1S/C15H20N2O/c1-11(2)15(18)17(3)14-13(9-10-16-14)12-7-5-4-6-8-12/h4-9,11,14,16H,10H2,1-3H3
InChIKeyFGZURBAQCWZUTR-UHFFFAOYSA-N
XLogP2.11
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide?
The IUPAC name of N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide (CID 174503151) is N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide.
What is the SMILES notation for N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide?
The canonical SMILES for N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide is CC(C)C(=O)N(C)C1NCC=C1c1ccccc1.
What is the InChIKey of N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide?
The InChIKey is FGZURBAQCWZUTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-11(2)15(18)17(3)14-13(9-10-16-14)12-7-5-4-6-8-12/h4-9,11,14,16H,10H2,1-3H3.
What are the key properties of N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide?
N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide has a molecular weight of 244.34 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(3-phenyl-2,5-dihydro-1H-pyrrol-2-yl)propanamide is sourced from PubChem (CID 174503151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).