2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide

C19H23FN2O3 — CID 42773488

IUPAC2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide
SMILESCCCN(CC(=O)N(Cc1ccc(F)cc1)Cc1ccco1)C(C)=O
InChIInChI=1S/C19H23FN2O3/c1-3-10-21(15(2)23)14-19(24)22(13-18-5-4-11-25-18)12-16-6-8-17(20)9-7-16/h4-9,11H,3,10,12-14H2,1-2H3
InChIKeyGCYNTYXWNYDMBN-UHFFFAOYSA-N
MW346.40 g/mol
LogP3.21
Rot. Bonds8

About 2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide

2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide (PubChem CID 42773488) has the molecular formula C19H23FN2O3 and a molecular weight of 346.40 g/mol. Its IUPAC name is 2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide
PubChem CID42773488
Molecular FormulaC19H23FN2O3
Molecular Weight346.40 g/mol
Exact Mass346.17
IUPAC Name2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide
SMILESCCCN(CC(=O)N(Cc1ccc(F)cc1)Cc1ccco1)C(C)=O
InChIInChI=1S/C19H23FN2O3/c1-3-10-21(15(2)23)14-19(24)22(13-18-5-4-11-25-18)12-16-6-8-17(20)9-7-16/h4-9,11H,3,10,12-14H2,1-2H3
InChIKeyGCYNTYXWNYDMBN-UHFFFAOYSA-N
XLogP3.21
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.40
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide (CID 42773488) is 2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide is CCCN(CC(=O)N(Cc1ccc(F)cc1)Cc1ccco1)C(C)=O.
What is the InChIKey of 2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide?
The InChIKey is GCYNTYXWNYDMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O3/c1-3-10-21(15(2)23)14-19(24)22(13-18-5-4-11-25-18)12-16-6-8-17(20)9-7-16/h4-9,11H,3,10,12-14H2,1-2H3.
What are the key properties of 2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide?
2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide has a molecular weight of 346.40 g/mol, XLogP of 3.21, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 42773488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).