N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide

C19H19N5O2 — CID 59374115

IUPACN',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide
SMILESCN(C)NC(=O)c1cccnc1Oc1ccc(Nc2ccccn2)cc1
InChIInChI=1S/C19H19N5O2/c1-24(2)23-18(25)16-6-5-13-21-19(16)26-15-10-8-14(9-11-15)22-17-7-3-4-12-20-17/h3-13H,1-2H3,(H,20,22)(H,23,25)
InChIKeyVFMWMJGKMIXIDP-UHFFFAOYSA-N
MW349.39 g/mol
LogP3.22
Rot. Bonds6

About N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide

N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide (PubChem CID 59374115) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide.

Molecular Properties

Compound NameN',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide
PubChem CID59374115
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC NameN',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide
SMILESCN(C)NC(=O)c1cccnc1Oc1ccc(Nc2ccccn2)cc1
InChIInChI=1S/C19H19N5O2/c1-24(2)23-18(25)16-6-5-13-21-19(16)26-15-10-8-14(9-11-15)22-17-7-3-4-12-20-17/h3-13H,1-2H3,(H,20,22)(H,23,25)
InChIKeyVFMWMJGKMIXIDP-UHFFFAOYSA-N
XLogP3.22
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide?
The IUPAC name of N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide (CID 59374115) is N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide.
What is the SMILES notation for N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide?
The canonical SMILES for N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide is CN(C)NC(=O)c1cccnc1Oc1ccc(Nc2ccccn2)cc1.
What is the InChIKey of N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide?
The InChIKey is VFMWMJGKMIXIDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2/c1-24(2)23-18(25)16-6-5-13-21-19(16)26-15-10-8-14(9-11-15)22-17-7-3-4-12-20-17/h3-13H,1-2H3,(H,20,22)(H,23,25).
What are the key properties of N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide?
N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide has a molecular weight of 349.39 g/mol, XLogP of 3.22, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-2-[4-(pyridin-2-ylamino)phenoxy]pyridine-3-carbohydrazide is sourced from PubChem (CID 59374115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).