(2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide

C17H21N3O2 — CID 100819947

IUPAC(2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide
SMILESC[C@H](Oc1ccn(-c2ccccc2)n1)C(=O)NC1CCCC1
InChIInChI=1S/C17H21N3O2/c1-13(17(21)18-14-7-5-6-8-14)22-16-11-12-20(19-16)15-9-3-2-4-10-15/h2-4,9-14H,5-8H2,1H3,(H,18,21)/t13-/m0/s1
InChIKeyFGEAYCJLPBDMKB-ZDUSSCGKSA-N
MW299.37 g/mol
LogP2.70
Rot. Bonds5

About (2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide

(2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide (PubChem CID 100819947) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is (2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide.

Molecular Properties

Compound Name(2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide
PubChem CID100819947
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC Name(2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide
SMILESC[C@H](Oc1ccn(-c2ccccc2)n1)C(=O)NC1CCCC1
InChIInChI=1S/C17H21N3O2/c1-13(17(21)18-14-7-5-6-8-14)22-16-11-12-20(19-16)15-9-3-2-4-10-15/h2-4,9-14H,5-8H2,1H3,(H,18,21)/t13-/m0/s1
InChIKeyFGEAYCJLPBDMKB-ZDUSSCGKSA-N
XLogP2.70
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-phenyl-2-(1-phenylpyrazol-3-yl)oxypropanamide
CID 100819963
(2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-(1-phenylpyrazol-3-yl)oxypropanamide
CID 100819925
(2S)-2-(4-chloro-1-phenylpyrazol-3-yl)oxy-N-cyclopentylpropanamide
CID 100829263
N-cyclopropyl-2-[(1-phenyl-1,2,4-triazol-3-yl)oxy]propanamide
CID 171138634
(2R)-N-benzyl-2-(1-phenylpyrazol-3-yl)oxypropanamide
CID 100819911
(2R)-2-(1-phenylpyrazol-3-yl)oxy-N-prop-2-enylpropanamide
CID 100828979
(2S)-2-(1-phenylpyrazol-3-yl)oxy-N-prop-2-enylpropanamide
CID 100828980
2-(1-phenylpyrazol-3-yl)oxy-N-(2-pyridin-2-ylethyl)propanamide
CID 102567154
(2R)-N-cycloheptyl-2-phenoxypropanamide
CID 669971
(2R)-N-(5-methyl-1,2-oxazol-3-yl)-2-(1-phenylpyrazol-3-yl)oxypropanamide
CID 100828981
3-[[(2S)-2-(1-phenylpyrazol-3-yl)oxypropanoyl]amino]benzamide
CID 100819977
1-phenyl-3-propan-2-yloxypyrazole
CID 176705910

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide?
The IUPAC name of (2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide (CID 100819947) is (2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide.
What is the SMILES notation for (2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide?
The canonical SMILES for (2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide is C[C@H](Oc1ccn(-c2ccccc2)n1)C(=O)NC1CCCC1.
What is the InChIKey of (2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide?
The InChIKey is FGEAYCJLPBDMKB-ZDUSSCGKSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-13(17(21)18-14-7-5-6-8-14)22-16-11-12-20(19-16)15-9-3-2-4-10-15/h2-4,9-14H,5-8H2,1H3,(H,18,21)/t13-/m0/s1.
What are the key properties of (2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide?
(2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide has a molecular weight of 299.37 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclopentyl-2-(1-phenylpyrazol-3-yl)oxypropanamide is sourced from PubChem (CID 100819947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).