(2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide

C19H21FN2O5 — CID 42091432

IUPAC(2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide
SMILESCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1
InChIInChI=1S/C19H21FN2O5/c1-12(26-16-6-4-14(20)5-7-16)18(23)21-22-19(24)13(2)27-17-10-8-15(25-3)9-11-17/h4-13H,1-3H3,(H,21,23)(H,22,24)/t12-,13+/m1/s1
InChIKeyAHDQZFRSQCSTED-OLZOCXBDSA-N
MW376.38 g/mol
LogP2.22
Rot. Bonds7

About (2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide

(2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide (PubChem CID 42091432) has the molecular formula C19H21FN2O5 and a molecular weight of 376.38 g/mol. Its IUPAC name is (2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide.

Molecular Properties

Compound Name(2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide
PubChem CID42091432
Molecular FormulaC19H21FN2O5
Molecular Weight376.38 g/mol
Exact Mass376.14
IUPAC Name(2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide
SMILESCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1
InChIInChI=1S/C19H21FN2O5/c1-12(26-16-6-4-14(20)5-7-16)18(23)21-22-19(24)13(2)27-17-10-8-15(25-3)9-11-17/h4-13H,1-3H3,(H,21,23)(H,22,24)/t12-,13+/m1/s1
InChIKeyAHDQZFRSQCSTED-OLZOCXBDSA-N
XLogP2.22
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.38
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(4-acetylphenoxy)-N'-[2-(4-fluorophenoxy)propanoyl]propanehydrazide
CID 24554519
N-[2-[2-[2-(4-fluorophenoxy)propanoyl]hydrazinyl]-2-oxoethyl]-4-methoxybenzenesulfonamide
CID 24638338
(2S)-N'-[3-(3,5-dimethoxyphenyl)propanoyl]-2-(4-fluorophenoxy)propanehydrazide
CID 9091757
N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide
CID 46521372
3,5-difluoro-N'-[2-(4-fluorophenoxy)propanoyl]benzohydrazide
CID 4820872
N'-[(2S)-2-(4-fluorophenoxy)propanoyl]-4-propan-2-yloxybenzohydrazide
CID 7965233
(2R)-2-(4-fluorophenoxy)-N-propan-2-ylpropanamide
CID 94335659
N'-[2-(4-fluorophenoxy)propanoyl]-3,3-dimethylbutanehydrazide
CID 46656768
4-[[(2S)-2-(4-fluorophenoxy)propanoyl]amino]-N-(4-methoxyphenyl)benzamide
CID 8884358
N'-(2-ethoxyacetyl)-2-(4-methoxyphenoxy)propanehydrazide
CID 17140896
1-ethyl-3-[2-(4-fluorophenoxy)propanoylamino]thiourea
CID 17373324
4-chloro-N'-[2-(4-fluorophenoxy)propanoyl]benzohydrazide
CID 24638274

Frequently Asked Questions

What is the IUPAC name of (2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide?
The IUPAC name of (2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide (CID 42091432) is (2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide.
What is the SMILES notation for (2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide?
The canonical SMILES for (2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide is COc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1.
What is the InChIKey of (2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide?
The InChIKey is AHDQZFRSQCSTED-OLZOCXBDSA-N. The full InChI is InChI=1S/C19H21FN2O5/c1-12(26-16-6-4-14(20)5-7-16)18(23)21-22-19(24)13(2)27-17-10-8-15(25-3)9-11-17/h4-13H,1-3H3,(H,21,23)(H,22,24)/t12-,13+/m1/s1.
What are the key properties of (2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide?
(2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide has a molecular weight of 376.38 g/mol, XLogP of 2.22, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide is sourced from PubChem (CID 42091432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).