hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide

C20H23N5O — CID 142938542

IUPAChydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide
SMILESNN.[H]/N=C(\N)c1cccc(NCc2ccc(Oc3ccccc3)cc2)c1
InChIInChI=1S/C20H19N3O.H4N2/c21-20(22)16-5-4-6-17(13-16)23-14-15-9-11-19(12-10-15)24-18-7-2-1-3-8-18;1-2/h1-13,23H,14H2,(H3,21,22);1-2H2
InChIKeyMPSBHONFRWLCQD-UHFFFAOYSA-N
MW349.44 g/mol
LogP3.19
Rot. Bonds6

About hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide

hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide (PubChem CID 142938542) has the molecular formula C20H23N5O and a molecular weight of 349.44 g/mol. Its IUPAC name is hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide.

Molecular Properties

Compound Namehydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide
PubChem CID142938542
Molecular FormulaC20H23N5O
Molecular Weight349.44 g/mol
Exact Mass349.19
IUPAC Namehydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide
SMILESNN.[H]/N=C(\N)c1cccc(NCc2ccc(Oc3ccccc3)cc2)c1
InChIInChI=1S/C20H19N3O.H4N2/c21-20(22)16-5-4-6-17(13-16)23-14-15-9-11-19(12-10-15)24-18-7-2-1-3-8-18;1-2/h1-13,23H,14H2,(H3,21,22);1-2H2
InChIKeyMPSBHONFRWLCQD-UHFFFAOYSA-N
XLogP3.19
TPSA123.17 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 53.19
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

hydrazine;4-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide
CID 142938635
N-imino-3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide
CID 142223846
4-[(4-phenylphenyl)methylamino]benzenecarboximidamide
CID 142223741
N'-diazenyl-3-[(4-phenylphenyl)methylamino]benzenecarboximidamide
CID 173497556
3-(benzylamino)-N-hydrazinylidenebenzenecarboximidamide
CID 142938740
3-[(4-ethoxyphenyl)methylamino]benzamide
CID 28650475
3-(2-phenoxyethoxy)benzenecarboximidamide;hydrochloride
CID 82253521
3-(3-methylbutylamino)benzenecarboximidamide
CID 70080138
1-[4-[3-(3-carbamimidoylphenoxy)propoxy]phenyl]-3-phenylurea
CID 100961082
3-carbamimidoyl-N-[[4-[4-[4-[[(3-carbamimidoylbenzoyl)amino]methyl]phenoxy]butoxy]phenyl]methyl]benzamide;3-carbamimidoyl-N-[[4-[5-[4-[[(3-carbamimidoylbenzoyl)amino]methyl]phenoxy]pentoxy]phenyl]methyl]benzamide
CID 157266807
3-[[4-[(3-carboxyphenoxy)methyl]phenyl]methylamino]benzoic acid
CID 118636142
3-[4-(aminomethyl)phenoxy]-5-(4-carbamimidoylphenoxy)benzamide
CID 68787822

Frequently Asked Questions

What is the IUPAC name of hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide?
The IUPAC name of hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide (CID 142938542) is hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide.
What is the SMILES notation for hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide?
The canonical SMILES for hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide is NN.[H]/N=C(\N)c1cccc(NCc2ccc(Oc3ccccc3)cc2)c1.
What is the InChIKey of hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide?
The InChIKey is MPSBHONFRWLCQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O.H4N2/c21-20(22)16-5-4-6-17(13-16)23-14-15-9-11-19(12-10-15)24-18-7-2-1-3-8-18;1-2/h1-13,23H,14H2,(H3,21,22);1-2H2.
What are the key properties of hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide?
hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide has a molecular weight of 349.44 g/mol, XLogP of 3.19, 6 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazine;3-[(4-phenoxyphenyl)methylamino]benzenecarboximidamide is sourced from PubChem (CID 142938542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).