N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide

C14H22N2O — CID 525889

IUPACN'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide
SMILESCOc1ccc(/N=C(\N(C)C)C(C)(C)C)cc1
InChIInChI=1S/C14H22N2O/c1-14(2,3)13(16(4)5)15-11-7-9-12(17-6)10-8-11/h7-10H,1-6H3/b15-13-
InChIKeyXHQOVLLDPIGXNM-SQFISAMPSA-N
MW234.34 g/mol
LogP3.33
Rot. Bonds2

About N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide

N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide (PubChem CID 525889) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide.

Molecular Properties

Compound NameN'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide
PubChem CID525889
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide
SMILESCOc1ccc(/N=C(\N(C)C)C(C)(C)C)cc1
InChIInChI=1S/C14H22N2O/c1-14(2,3)13(16(4)5)15-11-7-9-12(17-6)10-8-11/h7-10H,1-6H3/b15-13-
InChIKeyXHQOVLLDPIGXNM-SQFISAMPSA-N
XLogP3.33
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.33
H-Bond Donors ≤ 50
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

2-bromo-2,2-difluoro-N-(4-methoxyphenyl)ethanimidoyl chloride
CID 86064407
2-(4-methoxyphenyl)guanidine;hydrochloride
CID 22594132
N'-(4-methoxyphenyl)-N,N-dimethyl-2-phenylethanimidamide
CID 525856
1,1,1-trifluoro-N-(4-methoxyphenyl)propan-2-imine
CID 14116536
N-(4-chlorophenyl)-4-methoxybenzenecarboximidoyl chloride
CID 24827368
1,2,3-tris(4-methoxyphenyl)guanidine
CID 12737122
N-(4-methoxyphenyl)butan-2-imine
CID 15683591
1-[tert-butyl(dimethyl)silyl]-2,2,2-trifluoro-N-(4-methoxyphenyl)ethanimine
CID 10543533
N'-(4-methoxyphenyl)propanimidamide
CID 63174454
2,2,2-trifluoro-N-(4-methoxyphenyl)ethanimidoyl cyanide
CID 102573910
(E)-N-(4-methoxyphenyl)pent-3-en-2-imine
CID 134838595
2-hydroperoxypropan-2-yl-(4-methoxyphenyl)diazene
CID 23583552

Frequently Asked Questions

What is the IUPAC name of N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide?
The IUPAC name of N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide (CID 525889) is N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide.
What is the SMILES notation for N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide?
The canonical SMILES for N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide is COc1ccc(/N=C(\N(C)C)C(C)(C)C)cc1.
What is the InChIKey of N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide?
The InChIKey is XHQOVLLDPIGXNM-SQFISAMPSA-N. The full InChI is InChI=1S/C14H22N2O/c1-14(2,3)13(16(4)5)15-11-7-9-12(17-6)10-8-11/h7-10H,1-6H3/b15-13-.
What are the key properties of N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide?
N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide has a molecular weight of 234.34 g/mol, XLogP of 3.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-methoxyphenyl)-N,N,2,2-tetramethylpropanimidamide is sourced from PubChem (CID 525889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).