N'-(4-methoxyphenyl)propanimidamide

C10H14N2O — CID 63174454

IUPACN'-(4-methoxyphenyl)propanimidamide
SMILESCC/C(N)=N\c1ccc(OC)cc1
InChIInChI=1S/C10H14N2O/c1-3-10(11)12-8-4-6-9(13-2)7-5-8/h4-7H,3H2,1-2H3,(H2,11,12)
InChIKeyLZHNAZZAXGSFOP-UHFFFAOYSA-N
MW178.23 g/mol
LogP2.09
Rot. Bonds3

About N'-(4-methoxyphenyl)propanimidamide

N'-(4-methoxyphenyl)propanimidamide (PubChem CID 63174454) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is N'-(4-methoxyphenyl)propanimidamide.

Molecular Properties

Compound NameN'-(4-methoxyphenyl)propanimidamide
PubChem CID63174454
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC NameN'-(4-methoxyphenyl)propanimidamide
SMILESCC/C(N)=N\c1ccc(OC)cc1
InChIInChI=1S/C10H14N2O/c1-3-10(11)12-8-4-6-9(13-2)7-5-8/h4-7H,3H2,1-2H3,(H2,11,12)
InChIKeyLZHNAZZAXGSFOP-UHFFFAOYSA-N
XLogP2.09
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-(4-methoxyphenyl)butan-2-imine
CID 15683591
N'-[4-(methoxymethyl)phenyl]propanimidamide
CID 130496375
2-(4-methoxyphenyl)guanidine;hydrochloride
CID 22594132
N'-(4-iodophenyl)propanimidamide
CID 63173909
N-(4-methoxyphenyl)hexan-3-imine
CID 134897334
N'-(4-phenylphenyl)propanimidamide
CID 63178783
N'-(4-bromo-3-methoxyphenyl)propanimidamide
CID 82859122
2-[4-[5-(4-methoxyphenyl)furan-2-yl]phenyl]guanidine
CID 3007922
ethyl 2-(4-methoxyphenyl)-2-(4-methoxyphenyl)iminoacetate
CID 11370410
2-chloro-N'-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]ethanimidamide
CID 169366539
4-[[amino-(4-methoxyphenyl)methylidene]amino]benzoic acid
CID 142079900
1,2,3-tris(4-methoxyphenyl)guanidine
CID 12737122

Frequently Asked Questions

What is the IUPAC name of N'-(4-methoxyphenyl)propanimidamide?
The IUPAC name of N'-(4-methoxyphenyl)propanimidamide (CID 63174454) is N'-(4-methoxyphenyl)propanimidamide.
What is the SMILES notation for N'-(4-methoxyphenyl)propanimidamide?
The canonical SMILES for N'-(4-methoxyphenyl)propanimidamide is CC/C(N)=N\c1ccc(OC)cc1.
What is the InChIKey of N'-(4-methoxyphenyl)propanimidamide?
The InChIKey is LZHNAZZAXGSFOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-3-10(11)12-8-4-6-9(13-2)7-5-8/h4-7H,3H2,1-2H3,(H2,11,12).
What are the key properties of N'-(4-methoxyphenyl)propanimidamide?
N'-(4-methoxyphenyl)propanimidamide has a molecular weight of 178.23 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-methoxyphenyl)propanimidamide is sourced from PubChem (CID 63174454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).