N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide

C16H24FN3O — CID 63304113

IUPACN-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide
SMILESCCCN(CC(=O)NCc1ccc(F)cc1)C1CCNC1
InChIInChI=1S/C16H24FN3O/c1-2-9-20(15-7-8-18-11-15)12-16(21)19-10-13-3-5-14(17)6-4-13/h3-6,15,18H,2,7-12H2,1H3,(H,19,21)
InChIKeyILHWGJLJZNDQNG-UHFFFAOYSA-N
MW293.39 g/mol
LogP1.52
Rot. Bonds7

About N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide

N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide (PubChem CID 63304113) has the molecular formula C16H24FN3O and a molecular weight of 293.39 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide
PubChem CID63304113
Molecular FormulaC16H24FN3O
Molecular Weight293.39 g/mol
Exact Mass293.19
IUPAC NameN-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide
SMILESCCCN(CC(=O)NCc1ccc(F)cc1)C1CCNC1
InChIInChI=1S/C16H24FN3O/c1-2-9-20(15-7-8-18-11-15)12-16(21)19-10-13-3-5-14(17)6-4-13/h3-6,15,18H,2,7-12H2,1H3,(H,19,21)
InChIKeyILHWGJLJZNDQNG-UHFFFAOYSA-N
XLogP1.52
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluorophenyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921606
2-[propyl(pyrrolidin-3-yl)amino]-N-(thiophen-2-ylmethyl)acetamide;hydrochloride
CID 119921790
N-(cyclopropylmethyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921724
2-[azetidin-3-yl(propyl)amino]-N-(4-fluorophenyl)acetamide
CID 66213900
N-(2-methylpropyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921772
N-(2-phenoxyethyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide
CID 119921645
N-(2-cyanoethyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide
CID 63301073
N-ethyl-2-[piperidin-3-yl(propyl)amino]acetamide
CID 63638025
N'-acetyl-2-[propyl(pyrrolidin-3-yl)amino]acetohydrazide
CID 63300602
N-(ethylcarbamoyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921450
N-ethyl-2-[piperidin-4-yl(propyl)amino]acetamide
CID 60807335
N-propan-2-yl-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921653

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide (CID 63304113) is N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide is CCCN(CC(=O)NCc1ccc(F)cc1)C1CCNC1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide?
The InChIKey is ILHWGJLJZNDQNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FN3O/c1-2-9-20(15-7-8-18-11-15)12-16(21)19-10-13-3-5-14(17)6-4-13/h3-6,15,18H,2,7-12H2,1H3,(H,19,21).
What are the key properties of N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide?
N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide has a molecular weight of 293.39 g/mol, XLogP of 1.52, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-2-[propyl(pyrrolidin-3-yl)amino]acetamide is sourced from PubChem (CID 63304113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).