6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide

C24H26N4O3 — CID 143647903

IUPAC6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide
SMILESCC(C)c1nc(N)ccc1C(=O)NNC(=O)Cc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C24H26N4O3/c1-16(2)23-20(12-13-21(25)26-23)24(30)28-27-22(29)14-17-8-10-19(11-9-17)31-15-18-6-4-3-5-7-18/h3-13,16H,14-15H2,1-2H3,(H2,25,26)(H,27,29)(H,28,30)
InChIKeyGUPYKIQRTHZYML-UHFFFAOYSA-N
MW418.50 g/mol
LogP3.37
Rot. Bonds7

About 6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide

6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide (PubChem CID 143647903) has the molecular formula C24H26N4O3 and a molecular weight of 418.50 g/mol. Its IUPAC name is 6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide.

Molecular Properties

Compound Name6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide
PubChem CID143647903
Molecular FormulaC24H26N4O3
Molecular Weight418.50 g/mol
Exact Mass418.20
IUPAC Name6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide
SMILESCC(C)c1nc(N)ccc1C(=O)NNC(=O)Cc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C24H26N4O3/c1-16(2)23-20(12-13-21(25)26-23)24(30)28-27-22(29)14-17-8-10-19(11-9-17)31-15-18-6-4-3-5-7-18/h3-13,16H,14-15H2,1-2H3,(H2,25,26)(H,27,29)(H,28,30)
InChIKeyGUPYKIQRTHZYML-UHFFFAOYSA-N
XLogP3.37
TPSA106.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.50
LogP ≤ 53.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2,6-diamino-N-[(5-phenylmethoxy-2-pyridinyl)methyl]pyridine-3-carboxamide
CID 23130752
methyl 2-(4-phenylmethoxyphenyl)acetate
CID 2756645
3-oxo-4-(4-phenylmethoxyphenyl)butanoic acid
CID 143233810
3-[(4-phenylmethoxyphenyl)methyl]pyridine-2,6-diamine
CID 110186685
propan-2-yl 2-(4-phenylmethoxyphenyl)acetate
CID 82550165
methyl 2-(4-phenylmethoxyphenoxy)propanoate
CID 13093988
4-(2-phenoxyethoxy)-N'-(2-phenylacetyl)benzohydrazide
CID 4952867
2-oxo-3-(4-phenylmethoxyphenyl)propanoic acid
CID 563772
bis[(4-phenylmethoxyphenyl)methyl] propanedioate
CID 57028067
N'-(2-phenylacetyl)-4-propoxybenzohydrazide
CID 4938615
(2S)-2-amino-N-(5-methyl-4-propan-2-yl-1,3-thiazol-2-yl)-3-(4-phenylmethoxyphenyl)propanamide
CID 167771655
2-(2-methylpropoxy)-N'-(4-phenylmethoxybenzoyl)benzohydrazide
CID 4945737

Frequently Asked Questions

What is the IUPAC name of 6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide?
The IUPAC name of 6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide (CID 143647903) is 6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide.
What is the SMILES notation for 6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide?
The canonical SMILES for 6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide is CC(C)c1nc(N)ccc1C(=O)NNC(=O)Cc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide?
The InChIKey is GUPYKIQRTHZYML-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O3/c1-16(2)23-20(12-13-21(25)26-23)24(30)28-27-22(29)14-17-8-10-19(11-9-17)31-15-18-6-4-3-5-7-18/h3-13,16H,14-15H2,1-2H3,(H2,25,26)(H,27,29)(H,28,30).
What are the key properties of 6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide?
6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide has a molecular weight of 418.50 g/mol, XLogP of 3.37, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N'-[2-(4-phenylmethoxyphenyl)acetyl]-2-propan-2-ylpyridine-3-carbohydrazide is sourced from PubChem (CID 143647903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).