3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide

C19H25N3O3 — CID 2999792

IUPAC3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide
SMILESCC(=O)NC(CC(=O)NCC(c1ccco1)N(C)C)c1ccccc1
InChIInChI=1S/C19H25N3O3/c1-14(23)21-16(15-8-5-4-6-9-15)12-19(24)20-13-17(22(2)3)18-10-7-11-25-18/h4-11,16-17H,12-13H2,1-3H3,(H,20,24)(H,21,23)
InChIKeyINGNDLJQKMEYPE-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.27
Rot. Bonds8

About 3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide

3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide (PubChem CID 2999792) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide.

Molecular Properties

Compound Name3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide
PubChem CID2999792
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide
SMILESCC(=O)NC(CC(=O)NCC(c1ccco1)N(C)C)c1ccccc1
InChIInChI=1S/C19H25N3O3/c1-14(23)21-16(15-8-5-4-6-9-15)12-19(24)20-13-17(22(2)3)18-10-7-11-25-18/h4-11,16-17H,12-13H2,1-3H3,(H,20,24)(H,21,23)
InChIKeyINGNDLJQKMEYPE-UHFFFAOYSA-N
XLogP2.27
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide?
The IUPAC name of 3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide (CID 2999792) is 3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide.
What is the SMILES notation for 3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide?
The canonical SMILES for 3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide is CC(=O)NC(CC(=O)NCC(c1ccco1)N(C)C)c1ccccc1.
What is the InChIKey of 3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide?
The InChIKey is INGNDLJQKMEYPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-14(23)21-16(15-8-5-4-6-9-15)12-19(24)20-13-17(22(2)3)18-10-7-11-25-18/h4-11,16-17H,12-13H2,1-3H3,(H,20,24)(H,21,23).
What are the key properties of 3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide?
3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide has a molecular weight of 343.43 g/mol, XLogP of 2.27, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylpropanamide is sourced from PubChem (CID 2999792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).