(2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide

C19H25N3O — CID 156776033

IUPAC(2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide
SMILESCc1cccnc1NNC(=O)[C@@H](C)c1ccc(CC(C)C)cc1
InChIInChI=1S/C19H25N3O/c1-13(2)12-16-7-9-17(10-8-16)15(4)19(23)22-21-18-14(3)6-5-11-20-18/h5-11,13,15H,12H2,1-4H3,(H,20,21)(H,22,23)/t15-/m0/s1
InChIKeyOTUFOQZSHKPIQJ-HNNXBMFYSA-N
MW311.43 g/mol
LogP3.84
Rot. Bonds6

About (2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide

(2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide (PubChem CID 156776033) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is (2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide.

Molecular Properties

Compound Name(2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide
PubChem CID156776033
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name(2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide
SMILESCc1cccnc1NNC(=O)[C@@H](C)c1ccc(CC(C)C)cc1
InChIInChI=1S/C19H25N3O/c1-13(2)12-16-7-9-17(10-8-16)15(4)19(23)22-21-18-14(3)6-5-11-20-18/h5-11,13,15H,12H2,1-4H3,(H,20,21)(H,22,23)/t15-/m0/s1
InChIKeyOTUFOQZSHKPIQJ-HNNXBMFYSA-N
XLogP3.84
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(2,6-dimethylphenoxy)acetyl]-2-[4-(2-methylpropyl)phenyl]propanehydrazide
CID 54782220
N-(2-methylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 14456233
2-[4-(2-methylpropyl)phenyl]-N-(4-methylpyrimidin-2-yl)propanamide
CID 3627237
(2S)-2-[4-(2-methylpropyl)phenyl]-N-[(1S)-1-phenylethyl]propanamide
CID 1207292
2-[4-(2-methylpropyl)phenyl]propanehydrazide
CID 2736674
(2R)-N-[(2S)-1-hydroxypropan-2-yl]-2-[4-(2-methylpropyl)phenyl]propanamide
CID 11817897
N-butan-2-yl-2-[4-(2-methylpropyl)phenyl]propanamide
CID 11841279
(2R)-N-(3,5-dimethylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 1228330
(2S)-N-(3,5-dimethylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 1228329
N,2-bis[4-(2-methylpropyl)phenyl]propanamide
CID 3436173
(2R)-N-(3-hydroxyphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 675116
(2S)-N-(3,4-dimethylphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 1228270

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide?
The IUPAC name of (2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide (CID 156776033) is (2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide.
What is the SMILES notation for (2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide?
The canonical SMILES for (2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide is Cc1cccnc1NNC(=O)[C@@H](C)c1ccc(CC(C)C)cc1.
What is the InChIKey of (2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide?
The InChIKey is OTUFOQZSHKPIQJ-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-13(2)12-16-7-9-17(10-8-16)15(4)19(23)22-21-18-14(3)6-5-11-20-18/h5-11,13,15H,12H2,1-4H3,(H,20,21)(H,22,23)/t15-/m0/s1.
What are the key properties of (2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide?
(2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide has a molecular weight of 311.43 g/mol, XLogP of 3.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[4-(2-methylpropyl)phenyl]-N'-(3-methyl-2-pyridinyl)propanehydrazide is sourced from PubChem (CID 156776033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).