(2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide

C20H20FN3O — CID 95934298

IUPAC(2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide
SMILESC[C@H](C(=O)N(C)[C@H](c1ccccc1)c1ccc(F)cc1)n1cccn1
InChIInChI=1S/C20H20FN3O/c1-15(24-14-6-13-22-24)20(25)23(2)19(16-7-4-3-5-8-16)17-9-11-18(21)12-10-17/h3-15,19H,1-2H3/t15-,19-/m1/s1
InChIKeyCMAYBJZHAWLTMH-DNVCBOLYSA-N
MW337.40 g/mol
LogP3.83
Rot. Bonds5

About (2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide

(2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide (PubChem CID 95934298) has the molecular formula C20H20FN3O and a molecular weight of 337.40 g/mol. Its IUPAC name is (2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound Name(2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide
PubChem CID95934298
Molecular FormulaC20H20FN3O
Molecular Weight337.40 g/mol
Exact Mass337.16
IUPAC Name(2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide
SMILESC[C@H](C(=O)N(C)[C@H](c1ccccc1)c1ccc(F)cc1)n1cccn1
InChIInChI=1S/C20H20FN3O/c1-15(24-14-6-13-22-24)20(25)23(2)19(16-7-4-3-5-8-16)17-9-11-18(21)12-10-17/h3-15,19H,1-2H3/t15-,19-/m1/s1
InChIKeyCMAYBJZHAWLTMH-DNVCBOLYSA-N
XLogP3.83
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.40
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide?
The IUPAC name of (2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide (CID 95934298) is (2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for (2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide?
The canonical SMILES for (2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide is C[C@H](C(=O)N(C)[C@H](c1ccccc1)c1ccc(F)cc1)n1cccn1.
What is the InChIKey of (2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide?
The InChIKey is CMAYBJZHAWLTMH-DNVCBOLYSA-N. The full InChI is InChI=1S/C20H20FN3O/c1-15(24-14-6-13-22-24)20(25)23(2)19(16-7-4-3-5-8-16)17-9-11-18(21)12-10-17/h3-15,19H,1-2H3/t15-,19-/m1/s1.
What are the key properties of (2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide?
(2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide has a molecular weight of 337.40 g/mol, XLogP of 3.83, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(R)-(4-fluorophenyl)-phenylmethyl]-N-methyl-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 95934298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).