2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide

C19H21FN4O2 — CID 141016982

IUPAC2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide
SMILESNC(=O)Cc1ccc(NC(=O)Nc2ncccc2C2CCCC2)c(F)c1
InChIInChI=1S/C19H21FN4O2/c20-15-10-12(11-17(21)25)7-8-16(15)23-19(26)24-18-14(6-3-9-22-18)13-4-1-2-5-13/h3,6-10,13H,1-2,4-5,11H2,(H2,21,25)(H2,22,23,24,26)
InChIKeyZOQNZDABNWMHKO-UHFFFAOYSA-N
MW356.40 g/mol
LogP3.55
Rot. Bonds5

About 2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide

2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide (PubChem CID 141016982) has the molecular formula C19H21FN4O2 and a molecular weight of 356.40 g/mol. Its IUPAC name is 2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide.

Molecular Properties

Compound Name2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide
PubChem CID141016982
Molecular FormulaC19H21FN4O2
Molecular Weight356.40 g/mol
Exact Mass356.16
IUPAC Name2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide
SMILESNC(=O)Cc1ccc(NC(=O)Nc2ncccc2C2CCCC2)c(F)c1
InChIInChI=1S/C19H21FN4O2/c20-15-10-12(11-17(21)25)7-8-16(15)23-19(26)24-18-14(6-3-9-22-18)13-4-1-2-5-13/h3,6-10,13H,1-2,4-5,11H2,(H2,21,25)(H2,22,23,24,26)
InChIKeyZOQNZDABNWMHKO-UHFFFAOYSA-N
XLogP3.55
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 53.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-[1-[[2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-methylphenyl]acetyl]amino]-3-methylbutyl]-4,5-dihydro-1H-imidazol-5-yl]propanoic acid
CID 54178628
3-[4-[2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-(trifluoromethyl)phenyl]acetyl]-5-(2-methylpropyl)-2-oxopiperazin-1-yl]propanoic acid
CID 18313848
3-[4-[[2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-methoxyphenyl]acetyl]amino]-3-(2-methylpropyl)-2-oxopiperazin-1-yl]propanoic acid
CID 57123861
2-(2-cyclopentylphenyl)acetamide
CID 68862878
3-[4-[2-[3-cyclopentyl-4-[(3-methyl-2-pyridinyl)carbamoylamino]phenyl]acetyl]-3-(2-methylpropyl)-2-oxopiperazin-1-yl]propanoic acid
CID 18313976
2-[3-fluoro-4-(methanesulfonamido)phenyl]acetamide
CID 68721183
3-[(2,4-difluorophenyl)carbamoylamino]pyridine-2-carboxylic acid
CID 104740538
3-[3-[1-[[2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]phenyl]acetyl]amino]-3-methylbutyl]-4,5-dihydro-1,2-oxazol-5-yl]propanoic acid
CID 18313793
1-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(2,4-difluorophenyl)urea
CID 39891630
1-cycloheptyl-3-(2-fluoro-4-methylphenyl)urea
CID 47132817
1-cyclohexyl-3-(2-fluoro-4-methylphenyl)urea
CID 47103760
3-[[2-(3,4-difluorophenyl)acetyl]amino]pyridine-2-carboxylic acid
CID 104739842

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide?
The IUPAC name of 2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide (CID 141016982) is 2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide.
What is the SMILES notation for 2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide?
The canonical SMILES for 2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide is NC(=O)Cc1ccc(NC(=O)Nc2ncccc2C2CCCC2)c(F)c1.
What is the InChIKey of 2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide?
The InChIKey is ZOQNZDABNWMHKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN4O2/c20-15-10-12(11-17(21)25)7-8-16(15)23-19(26)24-18-14(6-3-9-22-18)13-4-1-2-5-13/h3,6-10,13H,1-2,4-5,11H2,(H2,21,25)(H2,22,23,24,26).
What are the key properties of 2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide?
2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide has a molecular weight of 356.40 g/mol, XLogP of 3.55, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(3-cyclopentyl-2-pyridinyl)carbamoylamino]-3-fluorophenyl]acetamide is sourced from PubChem (CID 141016982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).